4-[(3-methylphenyl)-methylsulfonyl-amino]-N-(2-pyrrolidin-1-ylcarbonylphenyl)butanamide

Systemtic Name: 4-[(3-methylphenyl)-methylsulfonyl-amino]-N-(2-pyrrolidin-1-ylcarbonylphenyl)butanamide Openeye Name: 4-(3-methyl-N-methylsulfonyl-anilino)-N-[2-(pyrrolidine-1-carbonyl)phenyl]butanamide CAS Name: 4-(3-methyl-N-methylsulfonylanilino)-N-[2-[oxo(1-pyrrolidinyl)methyl]phenyl]butanamide IUPAC Name: 4-(3-methyl-N-methylsulfonylanilino)-N-[2-(pyrrolidine-1-carbonyl)phenyl]butanamide Traditional Name: 4-(N-mesyl-3-methyl-anilino)-N-[2-(pyrrolidine-1-carbonyl)phenyl]butyramide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CCCC(=O)NC2=CC=CC=C2C(=O)N3CCCC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CCCC(=O)NC2=CC=CC=C2C(=O)N3CCCC3)S(=O)(=O)C

InChI

InChI=1S/C23H29N3O4S/c1-18-9-7-10-19(17-18)26(31(2,29)30)16-8-13-22(27)24-21-12-4-3-11-20(21)23(28)25-14-5-6-15-25/h3-4,7,9-12,17H,5-6,8,13-16H2,1-2H3,(H,24,27)