ethyl 2-[2-[(2-chlorophenyl)methylamino]ethanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(2-chlorophenyl)methylamino]ethanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[(2-chlorophenyl)methylamino]acetyl]amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(2-chlorophenyl)methylamino]-1-oxoethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(2-chlorophenyl)methylamino]acetyl]amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[(2-chlorobenzyl)amino]acetyl]amino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H21ClN2O3S MolecularWeight: 428.93174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CNCC3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CNCC3=CC=CC=C3Cl

InChI

InChI=1S/C22H21ClN2O3S/c1-2-28-22(27)17-12-19(15-8-4-3-5-9-15)29-21(17)25-20(26)14-24-13-16-10-6-7-11-18(16)23/h3-12,24H,2,13-14H2,1H3,(H,25,26)