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

Systemtic Name: 3-[(3-chlorophenyl)methyl]-5-[(4-methoxyphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(3-chlorophenyl)methyl]-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-[(3-chlorophenyl)methyl]-5-[(4-methoxyphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(3-chlorophenyl)methyl]-5-[(4-methoxyphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-(3-chlorobenzyl)-5-(p-anisylthio)-1,2,4-triazole Formula: C20H20ClN3OS MolecularWeight: 385.9103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)CC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H20ClN3OS/c1-3-11-24-19(13-16-5-4-6-17(21)12-16)22-23-20(24)26-14-15-7-9-18(25-2)10-8-15/h3-10,12H,1,11,13-14H2,2H3