(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethanol

Systemtic Name: (5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethanol Openeye Name: (4-allyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethanol CAS Name: [(5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]methanol IUPAC Name: (5-phenyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanylmethanol Traditional Name: [(4-allyl-5-phenyl-1,2,4-triazol-3-yl)thio]methanol Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCO)C2=CC=CC=C2

Isomeric SMILES

C=CCN1C(=NN=C1SCO)C2=CC=CC=C2

InChI

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