4-[(E)-(4-chlorophenyl)methylideneamino]-2-methyl-5-pyrazin-2-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-[(E)-(4-chlorophenyl)methylideneamino]-2-methyl-5-pyrazin-2-yl-1,2,4-triazole-3-thione Openeye Name: 4-[(E)-(4-chlorophenyl)methyleneamino]-2-methyl-5-pyrazin-2-yl-1,2,4-triazole-3-thione CAS Name: 4-[(E)-(4-chlorophenyl)methylideneamino]-2-methyl-5-(2-pyrazinyl)-1,2,4-triazole-3-thione IUPAC Name: 4-[(E)-(4-chlorophenyl)methylideneamino]-2-methyl-5-pyrazin-2-yl-1,2,4-triazole-3-thione Traditional Name: 4-[(E)-(4-chlorobenzylidene)amino]-2-methyl-5-pyrazin-2-yl-1,2,4-triazole-3-thione Formula: C14H11ClN6S MolecularWeight: 330.79534

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=S)N(C(=N1)C2=NC=CN=C2)N=CC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C(=S)N(C(=N1)C2=NC=CN=C2)/N=C/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H11ClN6S/c1-20-14(22)21(13(19-20)12-9-16-6-7-17-12)18-8-10-2-4-11(15)5-3-10/h2-9H,1H3/b18-8+