methyl 2-[2-[(4-aminocarbonylphenyl)methyl-cyclopropyl-amino]ethanoylamino]-4-(2-chlorophenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[(4-aminocarbonylphenyl)methyl-cyclopropyl-amino]ethanoylamino]-4-(2-chlorophenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[[2-[(4-carbamoylphenyl)methyl-cyclopropyl-amino]acetyl]amino]-4-(2-chlorophenyl)thiophene-3-carboxylate CAS Name: 2-[[2-[(4-carbamoylphenyl)methyl-cyclopropylamino]-1-oxoethyl]amino]-4-(2-chlorophenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[(4-carbamoylphenyl)methyl-cyclopropylamino]acetyl]amino]-4-(2-chlorophenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-[(4-carbamoylbenzyl)-cyclopropyl-amino]acetyl]amino]-4-(2-chlorophenyl)thiophene-3-carboxylic acid methyl ester Formula: C25H24ClN3O4S MolecularWeight: 497.99376

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)CN(CC3=CC=C(C=C3)C(=O)N)C4CC4

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)CN(CC3=CC=C(C=C3)C(=O)N)C4CC4

InChI

InChI=1S/C25H24ClN3O4S/c1-33-25(32)22-19(18-4-2-3-5-20(18)26)14-34-24(22)28-21(30)13-29(17-10-11-17)12-15-6-8-16(9-7-15)23(27)31/h2-9,14,17H,10-13H2,1H3,(H2,27,31)(H,28,30)