4-(1,3-benzodioxol-5-ylmethyl)-3-(2-chloranylprop-2-enylsulfanyl)-5-phenyl-1,2,4-triazole

Systemtic Name: 4-(1,3-benzodioxol-5-ylmethyl)-3-(2-chloranylprop-2-enylsulfanyl)-5-phenyl-1,2,4-triazole Openeye Name: 4-(1,3-benzodioxol-5-ylmethyl)-3-(2-chloroallylsulfanyl)-5-phenyl-1,2,4-triazole CAS Name: 4-(1,3-benzodioxol-5-ylmethyl)-3-(2-chloroprop-2-enylthio)-5-phenyl-1,2,4-triazole IUPAC Name: 4-(1,3-benzodioxol-5-ylmethyl)-3-(2-chloroprop-2-enylsulfanyl)-5-phenyl-1,2,4-triazole Traditional Name: 3-(2-chloroallylthio)-5-phenyl-4-piperonyl-1,2,4-triazole Formula: C19H16ClN3O2S MolecularWeight: 385.86724

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CSC1=NN=C(N1CC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)Cl

Isomeric SMILES

C=C(CSC1=NN=C(N1CC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C19H16ClN3O2S/c1-13(20)11-26-19-22-21-18(15-5-3-2-4-6-15)23(19)10-14-7-8-16-17(9-14)25-12-24-16/h2-9H,1,10-12H2