methyl 3-[2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]ethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-1-oxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]acetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-[cyclopropyl-(2,5-dimethoxybenzyl)amino]acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN(CC(=O)NC2=C(SC=C2)C(=O)OC)C3CC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN(CC(=O)NC2=C(SC=C2)C(=O)OC)C3CC3

InChI

InChI=1S/C20H24N2O5S/c1-25-15-6-7-17(26-2)13(10-15)11-22(14-4-5-14)12-18(23)21-16-8-9-28-19(16)20(24)27-3/h6-10,14H,4-5,11-12H2,1-3H3,(H,21,23)