phenethyl 4-oxidanylidene-4-(phenylcarbamothioylamino)butanoate

Systemtic Name: phenethyl 4-oxidanylidene-4-(phenylcarbamothioylamino)butanoate Openeye Name: phenethyl 4-oxo-4-(phenylcarbamothioylamino)butanoate CAS Name: 4-[[anilino(sulfanylidene)methyl]amino]-4-oxobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-oxo-4-(phenylcarbamothioylamino)butanoate Traditional Name: 4-keto-4-(phenylthiocarbamoylamino)butyric acid phenethyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O3S/c22-17(21-19(25)20-16-9-5-2-6-10-16)11-12-18(23)24-14-13-15-7-3-1-4-8-15/h1-10H,11-14H2,(H2,20,21,22,25)