ethyl 2-(2,3-dihydro-1H-inden-5-ylcarbamothioylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(2,3-dihydro-1H-inden-5-ylcarbamothioylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(indan-5-ylcarbamothioylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(2,3-dihydro-1H-inden-5-ylamino)-sulfanylidenemethyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2,3-dihydro-1H-inden-5-ylcarbamothioylamino)-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-(indan-5-ylthiocarbamoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C24H24N2O2S2 MolecularWeight: 436.58956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)NC3=CC4=C(CCC4)C=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)NC3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C24H24N2O2S2/c1-3-28-23(27)21-20(17-8-5-4-6-9-17)15(2)30-22(21)26-24(29)25-19-13-12-16-10-7-11-18(16)14-19/h4-6,8-9,12-14H,3,7,10-11H2,1-2H3,(H2,25,26,29)