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

Systemtic Name: 3-[(2S)-1-[(2-cyanophenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Openeye Name: 3-[(1S)-1-[(2-cyanophenyl)carbamoyl]propyl]sulfanyl-6-methyl-1,2,4-triazin-5-olate CAS Name: 3-[[(2S)-1-(2-cyanoanilino)-1-oxobutan-2-yl]thio]-6-methyl-1,2,4-triazin-5-olate IUPAC Name: 3-[(2S)-1-(2-cyanoanilino)-1-oxobutan-2-yl]sulfanyl-6-methyl-1,2,4-triazin-5-olate Traditional Name: 3-[[(1S)-1-[(2-cyanophenyl)carbamoyl]propyl]thio]-6-methyl-1,2,4-triazin-5-olate Formula: C15H14N5O2S- MolecularWeight: 328.36896

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C#N)SC2=NC(=C(N=N2)C)[O-]

Isomeric SMILES

CC[C@@H](C(=O)NC1=CC=CC=C1C#N)SC2=NC(=C(N=N2)C)[O-]

InChI

InChI=1S/C15H15N5O2S/c1-3-12(23-15-18-13(21)9(2)19-20-15)14(22)17-11-7-5-4-6-10(11)8-16/h4-7,12H,3H2,1-2H3,(H,17,22)(H,18,20,21)/p-1/t12-/m0/s1