ethyl 3-oxidanylidene-4-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-butanoate

Systemtic Name: ethyl 3-oxidanylidene-4-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-butanoate Openeye Name: ethyl 3-oxo-4-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-butanoate CAS Name: 4-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 3-oxo-4-[4-(phenylcarbamothioylamino)phenyl]sulfanylbutanoate Traditional Name: 3-keto-4-[[4-(phenylthiocarbamoylamino)phenyl]thio]butyric acid ethyl ester Formula: C19H20N2O3S2 MolecularWeight: 388.5037

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=CC=C(C=C1)NC(=S)NC2=CC=CC=C2

InChI

InChI=1S/C19H20N2O3S2/c1-2-24-18(23)12-16(22)13-26-17-10-8-15(9-11-17)21-19(25)20-14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3,(H2,20,21,25)