4-(4-chlorophenyl)-3-(3-phenylprop-2-enylsulfanyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazole

Systemtic Name: 4-(4-chlorophenyl)-3-(3-phenylprop-2-enylsulfanyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazole Openeye Name: 4-(4-chlorophenyl)-3-cinnamylsulfanyl-5-(2-thienylmethyl)-1,2,4-triazole CAS Name: 4-(4-chlorophenyl)-3-(3-phenylprop-2-enylthio)-5-(thiophen-2-ylmethyl)-1,2,4-triazole IUPAC Name: 4-(4-chlorophenyl)-3-(3-phenylprop-2-enylsulfanyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazole Traditional Name: 4-(4-chlorophenyl)-3-(cinnamylthio)-5-(2-thenyl)-1,2,4-triazole Formula: C22H18ClN3S2 MolecularWeight: 423.98142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCSC2=NN=C(N2C3=CC=C(C=C3)Cl)CC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C=CCSC2=NN=C(N2C3=CC=C(C=C3)Cl)CC4=CC=CS4

InChI

InChI=1S/C22H18ClN3S2/c23-18-10-12-19(13-11-18)26-21(16-20-9-5-14-27-20)24-25-22(26)28-15-4-8-17-6-2-1-3-7-17/h1-14H,15-16H2