3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-[(4-chlorophenyl)carbamoyl]phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-[(4-chlorophenyl)carbamoyl]phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-[(4-chlorophenyl)carbamoyl]phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[2-[(4-chloroanilino)-oxomethyl]phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-[(4-chlorophenyl)carbamoyl]phenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-[(4-chlorophenyl)carbamoyl]phenyl]benzamide Formula: C26H25Cl2N3O4S MolecularWeight: 546.4654

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC=C(C=C4)Cl)Cl

InChI

InChI=1S/C26H25Cl2N3O4S/c27-19-10-12-20(13-11-19)29-26(33)21-7-3-4-8-23(21)30-25(32)18-9-14-22(28)24(17-18)36(34,35)31-15-5-1-2-6-16-31/h3-4,7-14,17H,1-2,5-6,15-16H2,(H,29,33)(H,30,32)