3-[2-(3-methylphenoxy)ethylsulfanyl]-5-phenyl-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[2-(3-methylphenoxy)ethylsulfanyl]-5-phenyl-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[2-(3-methylphenoxy)ethylsulfanyl]-5-phenyl-1,2,4-triazole CAS Name: 3-[2-(3-methylphenoxy)ethylthio]-5-phenyl-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[2-(3-methylphenoxy)ethylsulfanyl]-5-phenyl-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[2-(3-methylphenoxy)ethylthio]-5-phenyl-1,2,4-triazole Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3OS/c1-3-12-23-19(17-9-5-4-6-10-17)21-22-20(23)25-14-13-24-18-11-7-8-16(2)15-18/h3-11,15H,1,12-14H2,2H3