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

Systemtic Name: 4-[5-[2-(3-methylphenoxy)ethylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-allyl-5-[2-(3-methylphenoxy)ethylsulfanyl]-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[2-(3-methylphenoxy)ethylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[2-(3-methylphenoxy)ethylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[4-allyl-5-[2-(3-methylphenoxy)ethylthio]-1,2,4-triazol-3-yl]pyridine Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCSC2=NN=C(N2CC=C)C3=CC=NC=C3

Isomeric SMILES

CC1=CC(=CC=C1)OCCSC2=NN=C(N2CC=C)C3=CC=NC=C3

InChI

InChI=1S/C19H20N4OS/c1-3-11-23-18(16-7-9-20-10-8-16)21-22-19(23)25-13-12-24-17-6-4-5-15(2)14-17/h3-10,14H,1,11-13H2,2H3