N-[2-[1-(thian-4-yl)piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide

Systemtic Name: N-[2-[1-(thian-4-yl)piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide Openeye Name: N-[2-(1-tetrahydrothiopyran-4-ylpiperidin-1-ium-4-yl)pyrazol-3-yl]pyridine-3-carboxamide CAS Name: N-[2-[1-(4-thianyl)-4-piperidin-1-iumyl]-3-pyrazolyl]-3-pyridinecarboxamide IUPAC Name: N-[2-[1-(thian-4-yl)piperidin-1-ium-4-yl]pyrazol-3-yl]pyridine-3-carboxamide Traditional Name: N-[2-(1-tetrahydrothiopyran-4-ylpiperidin-1-ium-4-yl)pyrazol-3-yl]nicotinamide Formula: C19H26N5OS+ MolecularWeight: 372.50764

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3=CN=CC=C3)C4CCSCC4

Isomeric SMILES

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3=CN=CC=C3)C4CCSCC4

InChI

InChI=1S/C19H25N5OS/c25-19(15-2-1-8-20-14-15)22-18-3-9-21-24(18)17-4-10-23(11-5-17)16-6-12-26-13-7-16/h1-3,8-9,14,16-17H,4-7,10-13H2,(H,22,25)/p+1