ethyl 4-[(methylcarbamothioylamino)-phenyl-amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[(methylcarbamothioylamino)-phenyl-amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-(N-(methylcarbamothioylamino)anilino)-4-oxo-butanoate CAS Name: 4-(N-[[methylamino(sulfanylidene)methyl]amino]anilino)-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(N-(methylcarbamothioylamino)anilino)-4-oxobutanoate Traditional Name: 4-keto-4-(N-(methylthiocarbamoylamino)anilino)butyric acid ethyl ester Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N(C1=CC=CC=C1)NC(=S)NC

Isomeric SMILES

CCOC(=O)CCC(=O)N(C1=CC=CC=C1)NC(=S)NC

InChI

InChI=1S/C14H19N3O3S/c1-3-20-13(19)10-9-12(18)17(16-14(21)15-2)11-7-5-4-6-8-11/h4-8H,3,9-10H2,1-2H3,(H2,15,16,21)