ethyl 2-(ethoxycarbothioylamino)-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(ethoxycarbothioylamino)-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(ethoxycarbothioylamino)-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[ethoxy(sulfanylidene)methyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(ethoxycarbothioylamino)-5-phenylthiophene-3-carboxylate Traditional Name: 2-(ethoxycarbothioylamino)-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C16H17NO3S2 MolecularWeight: 335.44108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)OCC

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)OCC

InChI

InChI=1S/C16H17NO3S2/c1-3-19-15(18)12-10-13(11-8-6-5-7-9-11)22-14(12)17-16(21)20-4-2/h5-10H,3-4H2,1-2H3,(H,17,21)