5-(azepan-1-ylsulfonyl)-N-(3-chloranyl-2-methyl-phenyl)-2-methyl-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-(3-chloranyl-2-methyl-phenyl)-2-methyl-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-(3-chloro-2-methyl-phenyl)-2-methyl-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-(3-chloro-2-methylphenyl)-2-methylbenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-(3-chloro-2-methylphenyl)-2-methylbenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-(3-chloro-2-methyl-phenyl)-2-methyl-benzamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NC3=C(C(=CC=C3)Cl)C

InChI

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