ethyl 2-(2-naphthalen-1-ylethanoylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(2-naphthalen-1-ylethanoylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(1-naphthyl)acetyl]carbamothioylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[[2-(1-naphthalenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-naphthalen-1-ylacetyl)carbamothioylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(1-naphthyl)acetyl]thiocarbamoylamino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C26H22N2O3S2 MolecularWeight: 474.59448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C26H22N2O3S2/c1-2-31-25(30)21-16-22(18-10-4-3-5-11-18)33-24(21)28-26(32)27-23(29)15-19-13-8-12-17-9-6-7-14-20(17)19/h3-14,16H,2,15H2,1H3,(H2,27,28,29,32)