N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-6-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridin-1-ium-3-carboxamide

Systemtic Name: N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-6-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridin-1-ium-3-carboxamide Openeye Name: N-[(4-ethylthiazol-2-yl)methyl]-6-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridin-1-ium-3-carboxamide CAS Name: N-[(4-ethyl-2-thiazolyl)methyl]-6-[methyl-[(1-methyl-4-pyrazolyl)methyl]amino]-3-pyridin-1-iumcarboxamide IUPAC Name: N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-6-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridin-1-ium-3-carboxamide Traditional Name: N-[(4-ethylthiazol-2-yl)methyl]-6-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridin-1-ium-3-carboxamide Formula: C18H23N6OS+ MolecularWeight: 371.47982

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CSC(=N1)CNC(=O)C2=C[NH+]=C(C=C2)N(C)CC3=CN(N=C3)C

Isomeric SMILES

CCC1=CSC(=N1)CNC(=O)C2=C[NH+]=C(C=C2)N(C)CC3=CN(N=C3)C

InChI

InChI=1S/C18H22N6OS/c1-4-15-12-26-17(22-15)9-20-18(25)14-5-6-16(19-8-14)23(2)10-13-7-21-24(3)11-13/h5-8,11-12H,4,9-10H2,1-3H3,(H,20,25)/p+1