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

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

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