N-[2-(azepan-1-ylcarbonyl)phenyl]-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-2-chloro-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-2-chloro-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-2-chloro-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-2-chloro-5-pyrrolidinosulfonyl-benzamide Formula: C24H28ClN3O4S MolecularWeight: 490.01482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=CC=C2NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCC4)Cl

InChI

InChI=1S/C24H28ClN3O4S/c25-21-12-11-18(33(31,32)28-15-7-8-16-28)17-20(21)23(29)26-22-10-4-3-9-19(22)24(30)27-13-5-1-2-6-14-27/h3-4,9-12,17H,1-2,5-8,13-16H2,(H,26,29)