1-[2-[(4-methoxyphenyl)carbonylamino]-4-methylsulfanyl-butanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[(4-methoxyphenyl)carbonylamino]-4-methylsulfanyl-butanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[(4-methoxybenzoyl)amino]-4-methylsulfanyl-butanoyl]piperidine-4-carboxamide CAS Name: 1-[2-[[(4-methoxyphenyl)-oxomethyl]amino]-4-(methylthio)-1-oxobutyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[(4-methoxybenzoyl)amino]-4-methylsulfanylbutanoyl]piperidine-4-carboxamide Traditional Name: 1-[4-(methylthio)-2-(p-anisoylamino)butanoyl]isonipecotamide Formula: C19H27N3O4S MolecularWeight: 393.50038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)N2CCC(CC2)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(CCSC)C(=O)N2CCC(CC2)C(=O)N

InChI

InChI=1S/C19H27N3O4S/c1-26-15-5-3-14(4-6-15)18(24)21-16(9-12-27-2)19(25)22-10-7-13(8-11-22)17(20)23/h3-6,13,16H,7-12H2,1-2H3,(H2,20,23)(H,21,24)