methyl 4-oxidanylidene-4-[(2-propan-2-ylphenyl)carbamothioylamino]butanoate

Systemtic Name: methyl 4-oxidanylidene-4-[(2-propan-2-ylphenyl)carbamothioylamino]butanoate Openeye Name: methyl 4-[(2-isopropylphenyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-oxo-4-[[(2-propan-2-ylanilino)-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-oxo-4-[(2-propan-2-ylphenyl)carbamothioylamino]butanoate Traditional Name: 4-keto-4-(o-cumenylthiocarbamoylamino)butyric acid methyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=S)NC(=O)CCC(=O)OC

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=S)NC(=O)CCC(=O)OC

InChI

InChI=1S/C15H20N2O3S/c1-10(2)11-6-4-5-7-12(11)16-15(21)17-13(18)8-9-14(19)20-3/h4-7,10H,8-9H2,1-3H3,(H2,16,17,18,21)