3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(2,3-dimethylphenyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(2,3-dimethylphenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2,3-dimethylphenyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-(2,3-dimethylphenyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2,3-dimethylphenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2,3-dimethylphenyl)benzamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C21H25ClN2O3S/c1-15-8-7-9-19(16(15)2)23-21(25)17-10-11-18(22)20(14-17)28(26,27)24-12-5-3-4-6-13-24/h7-11,14H,3-6,12-13H2,1-2H3,(H,23,25)