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3-(2-{4-[(1-{[3-(diethylcarbamoyl)phenyl]carbamoyl}-2-methylpropyl)carbamoyl]piperidin-1-yl}acetamido)-4-methyl-N-(2-methylphenyl)benzamide

3-(2-{4-[(1-{[3-(diethylcarbamoyl)phenyl]carbamoyl}-2-methylpropyl)carbamoyl]piperidin-1-yl}acetamido)-4-methyl-N-(2-methylphenyl)benzamide
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Compound number:
MolPort-017-470-042
IUPAC:
3-(2-{4-[(1-{[3-(diethylcarbamoyl)phenyl]carbamoyl}-2-methylpropyl)carbamoyl]piperidin-1-yl}acetamido)-4-methyl-N-(2-methylphenyl)benzamide
IUPAC traditional:
3-(2-{4-[(1-{[3-(diethylcarbamoyl)phenyl]carbamoyl}-2-methylpropyl)carbamoyl]piperidin-1-yl}acetamido)-4-methyl-N-(2-methylphenyl)benzamide
SMILES:
CCN(CC)C(=O)c1cccc(NC(=O)C(NC(=O)C2CCN(CC(=O)Nc3cc(ccc3C)C(=O)Nc3ccccc3C)CC2)C(C)C)c1
InChI key:
NRCFLWSJGNCZET-UHFFFAOYSA-N
Molecular formula:
C39H50N6O5
Molecular weight: 682.866

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Compound Identifiers
Compound number: MolPort-017-470-042

Names, Synonyms and 3rd Party Identifiers

InChI
InChI: 1S/C39H50N6O5/c1-7-45(8-2)39(50)30-13-11-14-31(22-30)40-38(49)35(25(3)4)43-36(47)28-18-20-44(21-19-28)24-34(46)41-33-23-29(17-16-27(33)6)37(48)42-32-15-10-9-12-26(32)5/h9-17,22-23,25,28,35H,7-8,18-21,24H2,1-6H3,(H,40,49)(H,41,46)(H,42,48)(H,43,47)
InChI key: NRCFLWSJGNCZET-UHFFFAOYSA-N

Calculated Properties
Molecular formula: C39H50N6O5
Molecular weight: 682.866

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2019 MolPort, v3.07, release date 17-07-2019 14:00 (+0200). All rights reserved.
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