3-(3-chloranyl-6-methoxy-1-benzothiophen-2-yl)-4-phenyl-5-(3-phenylprop-2-enylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(3-chloranyl-6-methoxy-1-benzothiophen-2-yl)-4-phenyl-5-(3-phenylprop-2-enylsulfanyl)-1,2,4-triazole Openeye Name: 3-(3-chloro-6-methoxy-benzothiophen-2-yl)-5-cinnamylsulfanyl-4-phenyl-1,2,4-triazole CAS Name: 3-(3-chloro-6-methoxy-1-benzothiophen-2-yl)-4-phenyl-5-(3-phenylprop-2-enylthio)-1,2,4-triazole IUPAC Name: 3-(3-chloro-6-methoxy-1-benzothiophen-2-yl)-4-phenyl-5-(3-phenylprop-2-enylsulfanyl)-1,2,4-triazole Traditional Name: 3-(3-chloro-6-methoxy-benzothiophen-2-yl)-5-(cinnamylthio)-4-phenyl-1,2,4-triazole Formula: C26H20ClN3OS2 MolecularWeight: 490.0395

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C3=NN=C(N3C4=CC=CC=C4)SCC=CC5=CC=CC=C5)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C3=NN=C(N3C4=CC=CC=C4)SCC=CC5=CC=CC=C5)Cl

InChI

InChI=1S/C26H20ClN3OS2/c1-31-20-14-15-21-22(17-20)33-24(23(21)27)25-28-29-26(30(25)19-12-6-3-7-13-19)32-16-8-11-18-9-4-2-5-10-18/h2-15,17H,16H2,1H3