5-(5-azanyl-1-phenyl-pyrazol-4-yl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(5-azanyl-1-phenyl-pyrazol-4-yl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate Openeye Name: 4-allyl-5-(5-amino-1-phenyl-pyrazol-4-yl)-1,2,4-triazole-3-thiolate CAS Name: 5-(5-amino-1-phenyl-4-pyrazolyl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-(5-amino-1-phenylpyrazol-4-yl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate Traditional Name: 4-allyl-5-(5-amino-1-phenyl-pyrazol-4-yl)-1,2,4-triazole-3-thiolate Formula: C14H13N6S- MolecularWeight: 297.35822

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1[S-])C2=C(N(N=C2)C3=CC=CC=C3)N

Isomeric SMILES

C=CCN1C(=NN=C1[S-])C2=C(N(N=C2)C3=CC=CC=C3)N

InChI

InChI=1S/C14H14N6S/c1-2-8-19-13(17-18-14(19)21)11-9-16-20(12(11)15)10-6-4-3-5-7-10/h2-7,9H,1,8,15H2,(H,18,21)/p-1