ethyl 2-[(2,6-dimethylmorpholin-4-yl)carbothioylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2,6-dimethylmorpholin-4-yl)carbothioylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(2,6-dimethylmorpholine-4-carbothioyl)amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(2,6-dimethyl-4-morpholinyl)-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2,6-dimethylmorpholine-4-carbothioyl)amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[(2,6-dimethylmorpholine-4-carbothioyl)amino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)N3CC(OC(C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)N3CC(OC(C3)C)C

InChI

InChI=1S/C20H24N2O3S2/c1-4-24-19(23)16-10-17(15-8-6-5-7-9-15)27-18(16)21-20(26)22-11-13(2)25-14(3)12-22/h5-10,13-14H,4,11-12H2,1-3H3,(H,21,26)