methyl 2-[2-[bis(phenylmethyl)amino]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[bis(phenylmethyl)amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(dibenzylamino)acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-[bis(phenylmethyl)amino]-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(dibenzylamino)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(dibenzylamino)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1)NC(=O)CN(CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(SC=C1)NC(=O)CN(CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O3S/c1-27-22(26)19-12-13-28-21(19)23-20(25)16-24(14-17-8-4-2-5-9-17)15-18-10-6-3-7-11-18/h2-13H,14-16H2,1H3,(H,23,25)