2-[1-(4-pyridin-2-ylpiperazin-1-yl)carbonylpiperidin-4-yl]-N-(2-pyrrol-1-ylphenyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[1-(4-pyridin-2-ylpiperazin-1-yl)carbonylpiperidin-4-yl]-N-(2-pyrrol-1-ylphenyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-[4-(2-pyridyl)piperazine-1-carbonyl]-4-piperidyl]-N-(2-pyrrol-1-ylphenyl)thiazole-4-carboxamide CAS Name: 2-[1-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-4-piperidinyl]-N-[2-(1-pyrrolyl)phenyl]-4-thiazolecarboxamide IUPAC Name: 2-[1-(4-pyridin-2-ylpiperazine-1-carbonyl)piperidin-4-yl]-N-(2-pyrrol-1-ylphenyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-[4-(2-pyridyl)piperazine-1-carbonyl]-4-piperidyl]-N-(2-pyrrol-1-ylphenyl)thiazole-4-carboxamide Formula: C29H31N7O2S MolecularWeight: 541.66714

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C(=O)NC3=CC=CC=C3N4C=CC=C4)C(=O)N5CCN(CC5)C6=CC=CC=N6

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C(=O)NC3=CC=CC=C3N4C=CC=C4)C(=O)N5CCN(CC5)C6=CC=CC=N6

InChI

InChI=1S/C29H31N7O2S/c37-27(31-23-7-1-2-8-25(23)33-13-5-6-14-33)24-21-39-28(32-24)22-10-15-35(16-11-22)29(38)36-19-17-34(18-20-36)26-9-3-4-12-30-26/h1-9,12-14,21-22H,10-11,15-20H2,(H,31,37)