3-[5-(phenylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 3-[5-(phenylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-(4-allyl-5-benzylsulfanyl-1,2,4-triazol-3-yl)pyridine CAS Name: 3-[5-(phenylmethylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-(5-benzylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)pyridine Traditional Name: 3-[4-allyl-5-(benzylthio)-1,2,4-triazol-3-yl]pyridine Formula: C17H16N4S MolecularWeight: 308.40074

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CN=CC=C3

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=CC=CC=C2)C3=CN=CC=C3

InChI

InChI=1S/C17H16N4S/c1-2-11-21-16(15-9-6-10-18-12-15)19-20-17(21)22-13-14-7-4-3-5-8-14/h2-10,12H,1,11,13H2