1-[1-(phenylmethyl)pyrazol-4-yl]carbonyl-N-(1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: 1-[1-(phenylmethyl)pyrazol-4-yl]carbonyl-N-(1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Openeye Name: 1-(1-benzylpyrazole-4-carbonyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide CAS Name: 1-[oxo-[1-(phenylmethyl)-4-pyrazolyl]methyl]-N-(1,3,4-thiadiazol-2-yl)-3-piperidinecarboxamide IUPAC Name: 1-(1-benzylpyrazole-4-carbonyl)-N-(1,3,4-thiadiazol-2-yl)piperidine-3-carboxamide Traditional Name: 1-(1-benzylpyrazole-4-carbonyl)-N-(1,3,4-thiadiazol-2-yl)nipecotamide Formula: C19H20N6O2S MolecularWeight: 396.4661

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CN(N=C2)CC3=CC=CC=C3)C(=O)NC4=NN=CS4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CN(N=C2)CC3=CC=CC=C3)C(=O)NC4=NN=CS4

InChI

InChI=1S/C19H20N6O2S/c26-17(22-19-23-20-13-28-19)15-7-4-8-24(11-15)18(27)16-9-21-25(12-16)10-14-5-2-1-3-6-14/h1-3,5-6,9,12-13,15H,4,7-8,10-11H2,(H,22,23,26)