N-(1,3-benzodioxol-5-yl)-N-ethyl-2-[1-(4-pyridin-2-ylpiperazin-1-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-N-ethyl-2-[1-(4-pyridin-2-ylpiperazin-1-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-N-ethyl-2-[1-[4-(2-pyridyl)piperazine-1-carbonyl]-4-piperidyl]thiazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-N-ethyl-2-[1-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-N-ethyl-2-[1-(4-pyridin-2-ylpiperazine-1-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-N-ethyl-2-[1-[4-(2-pyridyl)piperazine-1-carbonyl]-4-piperidyl]thiazole-4-carboxamide Formula: C28H32N6O4S MolecularWeight: 548.65648

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)OCO2)C(=O)C3=CSC(=N3)C4CCN(CC4)C(=O)N5CCN(CC5)C6=CC=CC=N6

Isomeric SMILES

CCN(C1=CC2=C(C=C1)OCO2)C(=O)C3=CSC(=N3)C4CCN(CC4)C(=O)N5CCN(CC5)C6=CC=CC=N6

InChI

InChI=1S/C28H32N6O4S/c1-2-34(21-6-7-23-24(17-21)38-19-37-23)27(35)22-18-39-26(30-22)20-8-11-32(12-9-20)28(36)33-15-13-31(14-16-33)25-5-3-4-10-29-25/h3-7,10,17-18,20H,2,8-9,11-16,19H2,1H3