ethyl 4-methyl-5-phenyl-2-[2-[(phenylmethyl)amino]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-5-phenyl-2-[2-[(phenylmethyl)amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(benzylamino)acetyl]amino]-4-methyl-5-phenyl-thiophene-3-carboxylate CAS Name: 4-methyl-2-[[1-oxo-2-[(phenylmethyl)amino]ethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(benzylamino)acetyl]amino]-4-methyl-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(benzylamino)acetyl]amino]-4-methyl-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C2=CC=CC=C2)NC(=O)CNCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C2=CC=CC=C2)NC(=O)CNCC3=CC=CC=C3

InChI

InChI=1S/C23H24N2O3S/c1-3-28-23(27)20-16(2)21(18-12-8-5-9-13-18)29-22(20)25-19(26)15-24-14-17-10-6-4-7-11-17/h4-13,24H,3,14-15H2,1-2H3,(H,25,26)