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

Systemtic Name: ethyl 4-oxidanylidene-4-[(2-propan-2-ylphenyl)carbamothioylamino]butanoate Openeye Name: ethyl 4-[(2-isopropylphenyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-oxo-4-[[(2-propan-2-ylanilino)-sulfanylidenemethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-oxo-4-[(2-propan-2-ylphenyl)carbamothioylamino]butanoate Traditional Name: 4-keto-4-(o-cumenylthiocarbamoylamino)butyric acid ethyl ester Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC(=S)NC1=CC=CC=C1C(C)C

Isomeric SMILES

CCOC(=O)CCC(=O)NC(=S)NC1=CC=CC=C1C(C)C

InChI

InChI=1S/C16H22N2O3S/c1-4-21-15(20)10-9-14(19)18-16(22)17-13-8-6-5-7-12(13)11(2)3/h5-8,11H,4,9-10H2,1-3H3,(H2,17,18,19,22)