N-(cyclopropylmethyl)-1-[3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]piperidine-3-carboxamide

Systemtic Name: N-(cyclopropylmethyl)-1-[3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]piperidine-3-carboxamide Openeye Name: N-(cyclopropylmethyl)-1-[3-methyl-2-(p-tolylsulfonylamino)butanoyl]piperidine-3-carboxamide CAS Name: N-(cyclopropylmethyl)-1-[3-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxobutyl]-3-piperidinecarboxamide IUPAC Name: N-(cyclopropylmethyl)-1-[3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]piperidine-3-carboxamide Traditional Name: N-(cyclopropylmethyl)-1-[3-methyl-2-(tosylamino)butanoyl]nipecotamide Formula: C22H33N3O4S MolecularWeight: 435.58012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)N2CCCC(C2)C(=O)NCC3CC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)N2CCCC(C2)C(=O)NCC3CC3

InChI

InChI=1S/C22H33N3O4S/c1-15(2)20(24-30(28,29)19-10-6-16(3)7-11-19)22(27)25-12-4-5-18(14-25)21(26)23-13-17-8-9-17/h6-7,10-11,15,17-18,20,24H,4-5,8-9,12-14H2,1-3H3,(H,23,26)