ethyl 5-chloranyl-2-[2-[cyclopentyl(methyl)amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-chloranyl-2-[2-[cyclopentyl(methyl)amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 5-chloro-2-[[2-[cyclopentyl(methyl)amino]acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 5-chloro-2-[[2-[cyclopentyl(methyl)amino]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-2-[[2-[cyclopentyl(methyl)amino]acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 5-chloro-2-[[2-[cyclopentyl(methyl)amino]acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)Cl)NC(=O)CN(C)C3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)Cl)NC(=O)CN(C)C3CCCC3

InChI

InChI=1S/C21H25ClN2O3S/c1-3-27-21(26)18-17(14-9-5-4-6-10-14)19(22)28-20(18)23-16(25)13-24(2)15-11-7-8-12-15/h4-6,9-10,15H,3,7-8,11-13H2,1-2H3,(H,23,25)