ethyl 2-[bis(phenylmethyl)carbamothioylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[bis(phenylmethyl)carbamothioylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(dibenzylcarbamothioylamino)-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[bis(phenylmethyl)amino]-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(dibenzylcarbamothioylamino)-5-phenylthiophene-3-carboxylate Traditional Name: 2-(dibenzylthiocarbamoylamino)-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C28H26N2O2S2 MolecularWeight: 486.64824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C28H26N2O2S2/c1-2-32-27(31)24-18-25(23-16-10-5-11-17-23)34-26(24)29-28(33)30(19-21-12-6-3-7-13-21)20-22-14-8-4-9-15-22/h3-18H,2,19-20H2,1H3,(H,29,33)