ethyl 2-[2-[cyclopropyl(propan-2-yl)amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[cyclopropyl(propan-2-yl)amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[cyclopropyl(isopropyl)amino]acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[cyclopropyl(propan-2-yl)amino]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[cyclopropyl(propan-2-yl)amino]acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[cyclopropyl(isopropyl)amino]acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CN(C3CC3)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CN(C3CC3)C(C)C

InChI

InChI=1S/C21H26N2O3S/c1-4-26-21(25)19-17(15-8-6-5-7-9-15)13-27-20(19)22-18(24)12-23(14(2)3)16-10-11-16/h5-9,13-14,16H,4,10-12H2,1-3H3,(H,22,24)