4-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-(2-piperidin-1-ylethyl)butanamide

Systemtic Name: 4-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-(2-piperidin-1-ylethyl)butanamide Openeye Name: 4-(3,4-dimethyl-N-methylsulfonyl-anilino)-N-[2-(1-piperidyl)ethyl]butanamide CAS Name: 4-(3,4-dimethyl-N-methylsulfonylanilino)-N-[2-(1-piperidinyl)ethyl]butanamide IUPAC Name: 4-(3,4-dimethyl-N-methylsulfonylanilino)-N-(2-piperidin-1-ylethyl)butanamide Traditional Name: 4-(N-mesyl-3,4-dimethyl-anilino)-N-(2-piperidinoethyl)butyramide Formula: C20H33N3O3S MolecularWeight: 395.55932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CCCC(=O)NCCN2CCCCC2)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CCCC(=O)NCCN2CCCCC2)S(=O)(=O)C)C

InChI

InChI=1S/C20H33N3O3S/c1-17-9-10-19(16-18(17)2)23(27(3,25)26)14-7-8-20(24)21-11-15-22-12-5-4-6-13-22/h9-10,16H,4-8,11-15H2,1-3H3,(H,21,24)