ethyl 4-(naphthalen-2-ylcarbamothioylamino)-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(naphthalen-2-ylcarbamothioylamino)-4-oxidanylidene-butanoate Openeye Name: ethyl 4-(2-naphthylcarbamothioylamino)-4-oxo-butanoate CAS Name: 4-[[(2-naphthalenylamino)-sulfanylidenemethyl]amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(naphthalen-2-ylcarbamothioylamino)-4-oxobutanoate Traditional Name: 4-keto-4-(2-naphthylthiocarbamoylamino)butyric acid ethyl ester Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC(=S)NC1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CCOC(=O)CCC(=O)NC(=S)NC1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C17H18N2O3S/c1-2-22-16(21)10-9-15(20)19-17(23)18-14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11H,2,9-10H2,1H3,(H2,18,19,20,23)