ethyl 5-ethyl-4-phenyl-2-(2-phenylethanethioylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-4-phenyl-2-(2-phenylethanethioylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-4-phenyl-2-[(2-phenylethanethioyl)amino]thiophene-3-carboxylate CAS Name: 5-ethyl-4-phenyl-2-[(2-phenyl-1-sulfanylideneethyl)amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-4-phenyl-2-[(2-phenylethanethioyl)amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-4-phenyl-2-[(2-phenylthioacetyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C23H23NO2S2 MolecularWeight: 409.56422

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(S1)NC(=S)CC2=CC=CC=C2)C(=O)OCC)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=C(S1)NC(=S)CC2=CC=CC=C2)C(=O)OCC)C3=CC=CC=C3

InChI

InChI=1S/C23H23NO2S2/c1-3-18-20(17-13-9-6-10-14-17)21(23(25)26-4-2)22(28-18)24-19(27)15-16-11-7-5-8-12-16/h5-14H,3-4,15H2,1-2H3,(H,24,27)