N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-1-oxido-pyridin-1-ium-3-carboxamide Formula: C15H14N6O2S2 MolecularWeight: 374.44066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=C[N+](=CC=C2)[O-])C3=NNC(=S)N3CC=C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=C[N+](=CC=C2)[O-])C3=NNC(=S)N3CC=C

InChI

InChI=1S/C15H14N6O2S2/c1-3-6-21-12(18-19-15(21)24)11-9(2)16-14(25-11)17-13(22)10-5-4-7-20(23)8-10/h3-5,7-8H,1,6H2,2H3,(H,19,24)(H,16,17,22)