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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(N2CC=C)SCC3=CC=C(C=C3)Cl

InChI

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