4-[5-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[5-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-allyl-5-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(2-methoxy-5-methylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[(2-methoxy-5-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[4-allyl-5-[(2-methoxy-5-methyl-benzyl)thio]-1,2,4-triazol-3-yl]pyridine Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CSC2=NN=C(N2CC=C)C3=CC=NC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CSC2=NN=C(N2CC=C)C3=CC=NC=C3

InChI

InChI=1S/C19H20N4OS/c1-4-11-23-18(15-7-9-20-10-8-15)21-22-19(23)25-13-16-12-14(2)5-6-17(16)24-3/h4-10,12H,1,11,13H2,2-3H3