2-[3-(4-chlorophenyl)carbonyl-4-methyl-phenyl]-3-(1H-pyrrol-2-yl)butane-2-sulfonamide

Systemtic Name: 2-[3-(4-chlorophenyl)carbonyl-4-methyl-phenyl]-3-(1H-pyrrol-2-yl)butane-2-sulfonamide Openeye Name: 2-[3-(4-chlorobenzoyl)-4-methyl-phenyl]-3-(1H-pyrrol-2-yl)butane-2-sulfonamide CAS Name: 2-[3-[(4-chlorophenyl)-oxomethyl]-4-methylphenyl]-3-(1H-pyrrol-2-yl)-2-butanesulfonamide IUPAC Name: 2-[3-(4-chlorobenzoyl)-4-methylphenyl]-3-(1H-pyrrol-2-yl)butane-2-sulfonamide Traditional Name: 2-[3-(4-chlorobenzoyl)-4-methyl-phenyl]-3-(1H-pyrrol-2-yl)butane-2-sulfonamide Formula: C22H23ClN2O3S MolecularWeight: 430.94762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C(C)C2=CC=CN2)S(=O)(=O)N)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C(C)C2=CC=CN2)S(=O)(=O)N)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H23ClN2O3S/c1-14-6-9-17(13-19(14)21(26)16-7-10-18(23)11-8-16)22(3,29(24,27)28)15(2)20-5-4-12-25-20/h4-13,15,25H,1-3H3,(H2,24,27,28)