5-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate Openeye Name: 4-allyl-5-(4-methyl-2-phenyl-thiazol-5-yl)-1,2,4-triazole-3-thiolate CAS Name: 5-(4-methyl-2-phenyl-5-thiazolyl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-4-prop-2-enyl-1,2,4-triazole-3-thiolate Traditional Name: 4-allyl-5-(4-methyl-2-phenyl-thiazol-5-yl)-1,2,4-triazole-3-thiolate Formula: C15H13N4S2- MolecularWeight: 313.42052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=C2)C3=NN=C(N3CC=C)[S-]

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=C2)C3=NN=C(N3CC=C)[S-]

InChI

InChI=1S/C15H14N4S2/c1-3-9-19-13(17-18-15(19)20)12-10(2)16-14(21-12)11-7-5-4-6-8-11/h3-8H,1,9H2,2H3,(H,18,20)/p-1