Mrv1820 03292414392D 20 21 0 0 0 0 999 V2000 -0.6868 0.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6868 1.3551 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1139 -1.1417 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0163 0.0951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3992 0.0951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7518 0.5267 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3992 -0.7263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1743 1.3551 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0163 -0.7263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0302 1.7658 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3992 1.7658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6893 -1.8099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5525 -0.4455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6868 -1.1440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4503 0.0951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7518 1.3551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1743 0.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4503 1.7658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8472 -1.6034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8959 1.7658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 7 1 0 0 0 0 4 1 2 0 0 0 0 5 1 1 0 0 0 0 6 4 1 0 0 0 0 7 5 2 0 0 0 0 8 18 1 0 0 0 0 9 4 1 0 0 0 0 10 2 1 0 0 0 0 11 2 2 0 0 0 0 12 3 2 0 0 0 0 13 3 2 0 0 0 0 14 7 1 0 0 0 0 15 6 1 0 0 0 0 16 6 1 0 0 0 0 17 15 1 0 0 0 0 18 16 1 0 0 0 0 19 3 1 0 0 0 0 20 8 1 0 0 0 0 14 9 2 0 0 0 0 8 17 1 0 0 0 0 M CHG 2 2 1 10 -1 M END > Molport-000-680-558 > https://www.molport.com/shop/compound/Molport-000-680-558 $$$$