ethyl 4-[(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)carbothioylamino]benzoate

Systemtic Name: ethyl 4-[(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)carbothioylamino]benzoate Openeye Name: ethyl 4-[(3-oxo-2,4-dihydroquinoxaline-1-carbothioyl)amino]benzoate CAS Name: 4-[[(3-oxo-2,4-dihydroquinoxalin-1-yl)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-oxo-2,4-dihydroquinoxaline-1-carbothioyl)amino]benzoate Traditional Name: 4-[(3-keto-2,4-dihydroquinoxaline-1-carbothioyl)amino]benzoic acid ethyl ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)N2CC(=O)NC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)N2CC(=O)NC3=CC=CC=C32

InChI

InChI=1S/C18H17N3O3S/c1-2-24-17(23)12-7-9-13(10-8-12)19-18(25)21-11-16(22)20-14-5-3-4-6-15(14)21/h3-10H,2,11H2,1H3,(H,19,25)(H,20,22)