[2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl] 2,4-dimethylthieno[3,2-b]pyrrole-5-carboxylate

Systemtic Name: [2-(cyclopentylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl] 2,4-dimethylthieno[3,2-b]pyrrole-5-carboxylate Openeye Name: [2-(cyclopentylamino)-2-oxo-1-(4-pyridyl)ethyl] 2,4-dimethylthieno[3,2-b]pyrrole-5-carboxylate CAS Name: 2,4-dimethyl-5-thieno[3,2-b]pyrrolecarboxylic acid [2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl] ester IUPAC Name: [2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl] 2,4-dimethylthieno[3,2-b]pyrrole-5-carboxylate Traditional Name: 2,4-dimethylthieno[3,2-b]pyrrole-5-carboxylic acid [2-(cyclopentylamino)-2-keto-1-(4-pyridyl)ethyl] ester Formula: C21H23N3O3S MolecularWeight: 397.49062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)C=C(N2C)C(=O)OC(C3=CC=NC=C3)C(=O)NC4CCCC4

Isomeric SMILES

CC1=CC2=C(S1)C=C(N2C)C(=O)OC(C3=CC=NC=C3)C(=O)NC4CCCC4

InChI

InChI=1S/C21H23N3O3S/c1-13-11-16-18(28-13)12-17(24(16)2)21(26)27-19(14-7-9-22-10-8-14)20(25)23-15-5-3-4-6-15/h7-12,15,19H,3-6H2,1-2H3,(H,23,25)