6-[(4-propan-2-ylphenyl)methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-olate

Systemtic Name: 6-[(4-propan-2-ylphenyl)methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-olate Openeye Name: 6-[(4-isopropylphenyl)methyl]-3-thioxo-2H-1,2,4-triazin-5-olate CAS Name: 6-[(4-propan-2-ylphenyl)methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-olate IUPAC Name: 6-[(4-propan-2-ylphenyl)methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-olate Traditional Name: 6-(4-isopropylbenzyl)-3-thioxo-2H-1,2,4-triazin-5-olate Formula: C13H14N3OS- MolecularWeight: 260.33476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CC2=NNC(=S)N=C2[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CC2=NNC(=S)N=C2[O-]

InChI

InChI=1S/C13H15N3OS/c1-8(2)10-5-3-9(4-6-10)7-11-12(17)14-13(18)16-15-11/h3-6,8H,7H2,1-2H3,(H2,14,16,17,18)/p-1