N-(4-pyrazol-1-ylphenyl)-1-(1,3-thiazol-2-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-(4-pyrazol-1-ylphenyl)-1-(1,3-thiazol-2-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-(4-pyrazol-1-ylphenyl)-1-(thiazol-2-ylmethyl)piperidin-1-ium-4-carboxamide CAS Name: N-[4-(1-pyrazolyl)phenyl]-1-(2-thiazolylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-(4-pyrazol-1-ylphenyl)-1-(1,3-thiazol-2-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: N-(4-pyrazol-1-ylphenyl)-1-(thiazol-2-ylmethyl)piperidin-1-ium-4-carboxamide Formula: C19H22N5OS+ MolecularWeight: 368.47588

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=C(C=C2)N3C=CC=N3)CC4=NC=CS4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=C(C=C2)N3C=CC=N3)CC4=NC=CS4

InChI

InChI=1S/C19H21N5OS/c25-19(15-6-11-23(12-7-15)14-18-20-9-13-26-18)22-16-2-4-17(5-3-16)24-10-1-8-21-24/h1-5,8-10,13,15H,6-7,11-12,14H2,(H,22,25)/p+1