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

Systemtic Name: 4-[5-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[4-allyl-5-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[2-(3,5-dimethylphenoxy)ethylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[4-allyl-5-[2-(3,5-dimethylphenoxy)ethylthio]-1,2,4-triazol-3-yl]pyridine Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4OS/c1-4-9-24-19(17-5-7-21-8-6-17)22-23-20(24)26-11-10-25-18-13-15(2)12-16(3)14-18/h4-8,12-14H,1,9-11H2,2-3H3