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

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

CCC(C(=O)NCCN1CCCCC1)N(C2=CC(=C(C=C2)C)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NCCN1CCCCC1)N(C2=CC(=C(C=C2)C)C)S(=O)(=O)C

InChI

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