3-[(4-methoxyphenyl)methylsulfanyl]-5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(4-methoxyphenyl)methylsulfanyl]-5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(4-methoxyphenyl)methylsulfanyl]-5-(m-tolyl)-1,2,4-triazole CAS Name: 3-[(4-methoxyphenyl)methylthio]-5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(4-methoxyphenyl)methylsulfanyl]-5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-(m-tolyl)-5-(p-anisylthio)-1,2,4-triazole Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H21N3OS/c1-4-12-23-19(17-7-5-6-15(2)13-17)21-22-20(23)25-14-16-8-10-18(24-3)11-9-16/h4-11,13H,1,12,14H2,2-3H3