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

Systemtic Name: N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-6-[methyl(propan-2-yl)amino]pyridin-1-ium-3-carboxamide Openeye Name: N-[(4-ethylthiazol-2-yl)methyl]-6-[isopropyl(methyl)amino]pyridin-1-ium-3-carboxamide CAS Name: N-[(4-ethyl-2-thiazolyl)methyl]-6-[methyl(propan-2-yl)amino]-3-pyridin-1-iumcarboxamide IUPAC Name: N-[(4-ethyl-1,3-thiazol-2-yl)methyl]-6-[methyl(propan-2-yl)amino]pyridin-1-ium-3-carboxamide Traditional Name: N-[(4-ethylthiazol-2-yl)methyl]-6-[isopropyl(methyl)amino]pyridin-1-ium-3-carboxamide Formula: C16H23N4OS+ MolecularWeight: 319.44502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4OS/c1-5-13-10-22-15(19-13)9-18-16(21)12-6-7-14(17-8-12)20(4)11(2)3/h6-8,10-11H,5,9H2,1-4H3,(H,18,21)/p+1