2-(hydroxymethyl)-5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazole-3-thione

Systemtic Name: 2-(hydroxymethyl)-5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-2-(hydroxymethyl)-5-(4-methoxyphenyl)-1,2,4-triazole-3-thione CAS Name: 2-(hydroxymethyl)-5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 2-(hydroxymethyl)-5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-5-(4-methoxyphenyl)-2-methylol-1,2,4-triazole-3-thione Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=S)N2CC=C)CO

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=S)N2CC=C)CO

InChI

InChI=1S/C13H15N3O2S/c1-3-8-15-12(14-16(9-17)13(15)19)10-4-6-11(18-2)7-5-10/h3-7,17H,1,8-9H2,2H3