propan-2-yl 2-[(4-methoxyphenyl)carbonylcarbamothioylamino]-4-methylsulfanyl-butanoate

Systemtic Name: propan-2-yl 2-[(4-methoxyphenyl)carbonylcarbamothioylamino]-4-methylsulfanyl-butanoate Openeye Name: isopropyl 2-[(4-methoxybenzoyl)carbamothioylamino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[[(4-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-(methylthio)butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(4-methoxybenzoyl)carbamothioylamino]-4-methylsulfanylbutanoate Traditional Name: 4-(methylthio)-2-(p-anisoylthiocarbamoylamino)butyric acid isopropyl ester Formula: C17H24N2O4S2 MolecularWeight: 384.51346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CCSC)NC(=S)NC(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

CC(C)OC(=O)C(CCSC)NC(=S)NC(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C17H24N2O4S2/c1-11(2)23-16(21)14(9-10-25-4)18-17(24)19-15(20)12-5-7-13(22-3)8-6-12/h5-8,11,14H,9-10H2,1-4H3,(H2,18,19,20,24)