N-(1,3-benzodioxol-5-yl)-N-ethyl-2-[1-(5-methyl-1-phenyl-pyrazol-4-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-N-ethyl-2-[1-(5-methyl-1-phenyl-pyrazol-4-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-N-ethyl-2-[1-(5-methyl-1-phenyl-pyrazole-4-carbonyl)-4-piperidyl]thiazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-N-ethyl-2-[1-[(5-methyl-1-phenyl-4-pyrazolyl)-oxomethyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-N-ethyl-2-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-N-ethyl-2-[1-(5-methyl-1-phenyl-pyrazole-4-carbonyl)-4-piperidyl]thiazole-4-carboxamide Formula: C29H29N5O4S MolecularWeight: 543.63666

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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)C5=C(N(N=C5)C6=CC=CC=C6)C

Isomeric SMILES

CCN(C1=CC2=C(C=C1)OCO2)C(=O)C3=CSC(=N3)C4CCN(CC4)C(=O)C5=C(N(N=C5)C6=CC=CC=C6)C

InChI

InChI=1S/C29H29N5O4S/c1-3-33(22-9-10-25-26(15-22)38-18-37-25)29(36)24-17-39-27(31-24)20-11-13-32(14-12-20)28(35)23-16-30-34(19(23)2)21-7-5-4-6-8-21/h4-10,15-17,20H,3,11-14,18H2,1-2H3