2-(1-methylpyrazol-4-yl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(1-methylpyrazol-4-yl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(1-methylpyrazol-4-yl)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]thiazole-4-carboxamide CAS Name: 2-(1-methyl-4-pyrazolyl)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-4-thiazolecarboxamide IUPAC Name: 2-(1-methylpyrazol-4-yl)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-1,3-thiazole-4-carboxamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide Formula: C17H17N7O2S MolecularWeight: 383.42758

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC(=CS2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

CN1C=C(C=N1)C2=NC(=CS2)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C17H17N7O2S/c1-23-8-11(6-20-23)17-22-13(10-27-17)16(26)21-12-2-3-14(19-7-12)24-5-4-18-15(25)9-24/h2-3,6-8,10H,4-5,9H2,1H3,(H,18,25)(H,21,26)