4-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-6-methyl-3-sulfanylidene-1,2,4-triazin-5-olate

Systemtic Name: 4-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-6-methyl-3-sulfanylidene-1,2,4-triazin-5-olate Openeye Name: 4-[(Z)-1,3-benzodioxol-5-ylmethyleneamino]-6-methyl-3-thioxo-1,2,4-triazin-5-olate CAS Name: 4-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-6-methyl-3-sulfanylidene-1,2,4-triazin-5-olate IUPAC Name: 4-[(Z)-1,3-benzodioxol-5-ylmethylideneamino]-6-methyl-3-sulfanylidene-1,2,4-triazin-5-olate Traditional Name: 6-methyl-4-[(Z)-piperonylideneamino]-3-thioxo-1,2,4-triazin-5-olate Formula: C12H9N4O3S- MolecularWeight: 289.28986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=S)N=N1)N=CC2=CC3=C(C=C2)OCO3)[O-]

Isomeric SMILES

CC1=C(N(C(=S)N=N1)/N=C\C2=CC3=C(C=C2)OCO3)[O-]

InChI

InChI=1S/C12H10N4O3S/c1-7-11(17)16(12(20)15-14-7)13-5-8-2-3-9-10(4-8)19-6-18-9/h2-5,17H,6H2,1H3/p-1/b13-5-