N-(1,3-benzodioxol-5-yl)-1-[[2-(1-methylpyrazol-4-yl)-1,3-thiazol-4-yl]carbonyl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[[2-(1-methylpyrazol-4-yl)-1,3-thiazol-4-yl]carbonyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-[2-(1-methylpyrazol-4-yl)thiazole-4-carbonyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[[2-(1-methyl-4-pyrazolyl)-4-thiazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-[2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carbonyl]piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-[2-(1-methylpyrazol-4-yl)thiazole-4-carbonyl]isonipecotamide Formula: C21H21N5O4S MolecularWeight: 439.48754

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC(=CS2)C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C=C(C=N1)C2=NC(=CS2)C(=O)N3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H21N5O4S/c1-25-10-14(9-22-25)20-24-16(11-31-20)21(28)26-6-4-13(5-7-26)19(27)23-15-2-3-17-18(8-15)30-12-29-17/h2-3,8-11,13H,4-7,12H2,1H3,(H,23,27)