3-[2-[(4-dimethylaminophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate

Systemtic Name: 3-[2-[(4-dimethylaminophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-[4-(dimethylamino)anilino]-2-oxo-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate CAS Name: 3-[[2-[4-(dimethylamino)anilino]-2-oxoethyl]thio]-6-methyl-1,2,4-triazin-5-olate IUPAC Name: 3-[2-[4-(dimethylamino)anilino]-2-oxoethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Traditional Name: 3-[[2-[4-(dimethylamino)anilino]-2-keto-ethyl]thio]-6-methyl-1,2,4-triazin-5-olate Formula: C14H16N5O2S- MolecularWeight: 318.37414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=N1)SCC(=O)NC2=CC=C(C=C2)N(C)C)[O-]

Isomeric SMILES

CC1=C(N=C(N=N1)SCC(=O)NC2=CC=C(C=C2)N(C)C)[O-]

InChI

InChI=1S/C14H17N5O2S/c1-9-13(21)16-14(18-17-9)22-8-12(20)15-10-4-6-11(7-5-10)19(2)3/h4-7H,8H2,1-3H3,(H,15,20)(H,16,18,21)/p-1