ethyl 2-[2-[bis(phenylmethyl)amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[bis(phenylmethyl)amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(dibenzylamino)acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[bis(phenylmethyl)amino]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(dibenzylamino)acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(dibenzylamino)acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C29H28N2O3S MolecularWeight: 484.60922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CN(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CN(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C29H28N2O3S/c1-2-34-29(33)27-25(24-16-10-5-11-17-24)21-35-28(27)30-26(32)20-31(18-22-12-6-3-7-13-22)19-23-14-8-4-9-15-23/h3-17,21H,2,18-20H2,1H3,(H,30,32)