3-phenylmethoxy-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-phenylmethoxy-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-benzyloxy-1H-1,2,4-triazole-5-thione CAS Name: 3-phenylmethoxy-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-phenylmethoxy-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-benzoxy-1H-1,2,4-triazole-5-thione Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=S)NN=C1OCC2=CC=CC=C2

Isomeric SMILES

C=CCN1C(=S)NN=C1OCC2=CC=CC=C2

InChI

InChI=1S/C12H13N3OS/c1-2-8-15-11(13-14-12(15)17)16-9-10-6-4-3-5-7-10/h2-7H,1,8-9H2,(H,14,17)