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

Systemtic Name: ethyl 2-[2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[cyclopropyl-[(2,5-dimethoxyphenyl)methyl]amino]acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-[cyclopropyl-(2,5-dimethoxybenzyl)amino]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1)NC(=O)CN(CC2=C(C=CC(=C2)OC)OC)C3CC3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1)NC(=O)CN(CC2=C(C=CC(=C2)OC)OC)C3CC3

InChI

InChI=1S/C21H26N2O5S/c1-4-28-21(25)17-9-10-29-20(17)22-19(24)13-23(15-5-6-15)12-14-11-16(26-2)7-8-18(14)27-3/h7-11,15H,4-6,12-13H2,1-3H3,(H,22,24)