3-(5-azanyl-1-phenyl-pyrazol-4-yl)-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(5-azanyl-1-phenyl-pyrazol-4-yl)-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(5-amino-1-phenyl-pyrazol-4-yl)-4-benzyl-1H-1,2,4-triazole-5-thione CAS Name: 3-(5-amino-1-phenyl-4-pyrazolyl)-4-(phenylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(5-amino-1-phenylpyrazol-4-yl)-4-benzyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(5-amino-1-phenyl-pyrazol-4-yl)-4-benzyl-1H-1,2,4-triazole-5-thione Formula: C18H16N6S MolecularWeight: 348.42484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NNC2=S)C3=C(N(N=C3)C4=CC=CC=C4)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NNC2=S)C3=C(N(N=C3)C4=CC=CC=C4)N

InChI

InChI=1S/C18H16N6S/c19-16-15(11-20-24(16)14-9-5-2-6-10-14)17-21-22-18(25)23(17)12-13-7-3-1-4-8-13/h1-11H,12,19H2,(H,22,25)