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

Systemtic Name: [2-[bis(phenylmethyl)amino]-2-oxidanylidene-ethyl] 2-(cyclopropylcarbonylamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: [2-(dibenzylamino)-2-oxo-ethyl] 2-(cyclopropanecarbonylamino)-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[cyclopropyl(oxo)methyl]amino]-4-phenyl-3-thiophenecarboxylic acid [2-[bis(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-(dibenzylamino)-2-oxoethyl] 2-(cyclopropanecarbonylamino)-4-phenylthiophene-3-carboxylate Traditional Name: 2-(cyclopropanecarbonylamino)-4-phenyl-thiophene-3-carboxylic acid [2-(dibenzylamino)-2-keto-ethyl] ester Formula: C31H28N2O4S MolecularWeight: 524.63002

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OCC(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CC1C(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OCC(=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C31H28N2O4S/c34-27(33(18-22-10-4-1-5-11-22)19-23-12-6-2-7-13-23)20-37-31(36)28-26(24-14-8-3-9-15-24)21-38-30(28)32-29(35)25-16-17-25/h1-15,21,25H,16-20H2,(H,32,35)