6-cyclohexyl-5-phenyl-4-(pyridin-3-ylmethyl)thieno[3,2-b]pyrrole-2-carboxylic acid

Systemtic Name: 6-cyclohexyl-5-phenyl-4-(pyridin-3-ylmethyl)thieno[3,2-b]pyrrole-2-carboxylic acid Openeye Name: 6-cyclohexyl-5-phenyl-4-(3-pyridylmethyl)thieno[3,2-b]pyrrole-2-carboxylic acid CAS Name: 6-cyclohexyl-5-phenyl-4-(3-pyridinylmethyl)-2-thieno[3,2-b]pyrrolecarboxylic acid IUPAC Name: 6-cyclohexyl-5-phenyl-4-(pyridin-3-ylmethyl)thieno[3,2-b]pyrrole-2-carboxylic acid Traditional Name: 6-cyclohexyl-5-phenyl-4-(3-pyridylmethyl)thieno[3,2-b]pyrrole-2-carboxylic acid Formula: C25H24N2O2S MolecularWeight: 416.53526

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N(C3=C2SC(=C3)C(=O)O)CC4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2SC(=C3)C(=O)O)CC4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H24N2O2S/c28-25(29)21-14-20-24(30-21)22(18-9-3-1-4-10-18)23(19-11-5-2-6-12-19)27(20)16-17-8-7-13-26-15-17/h2,5-8,11-15,18H,1,3-4,9-10,16H2,(H,28,29)