3-[(2S)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-6-methyl-1,2,4-triazin-5-olate

Systemtic Name: 3-[(2S)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Openeye Name: 3-[(1S)-2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate CAS Name: 3-[[(2S)-1-(2-cyanoanilino)-1-oxopropan-2-yl]thio]-6-methyl-1,2,4-triazin-5-olate IUPAC Name: 3-[(2S)-1-(2-cyanoanilino)-1-oxopropan-2-yl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Traditional Name: 3-[[(1S)-2-(2-cyanoanilino)-2-keto-1-methyl-ethyl]thio]-6-methyl-1,2,4-triazin-5-olate Formula: C14H12N5O2S- MolecularWeight: 314.34238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=N1)SC(C)C(=O)NC2=CC=CC=C2C#N)[O-]

Isomeric SMILES

CC1=C(N=C(N=N1)S[C@@H](C)C(=O)NC2=CC=CC=C2C#N)[O-]

InChI

InChI=1S/C14H13N5O2S/c1-8-12(20)17-14(19-18-8)22-9(2)13(21)16-11-6-4-3-5-10(11)7-15/h3-6,9H,1-2H3,(H,16,21)(H,17,19,20)/p-1/t9-/m0/s1