(2E)-5-methyl-3-phenyl-2-(4-phenyl-3-propylsulfanyl-1H-1,2,4-triazol-5-ylidene)indole

Systemtic Name: (2E)-5-methyl-3-phenyl-2-(4-phenyl-3-propylsulfanyl-1H-1,2,4-triazol-5-ylidene)indole Openeye Name: (2E)-5-methyl-3-phenyl-2-(4-phenyl-3-propylsulfanyl-1H-1,2,4-triazol-5-ylidene)indole CAS Name: (2E)-5-methyl-3-phenyl-2-[4-phenyl-3-(propylthio)-1H-1,2,4-triazol-5-ylidene]indole IUPAC Name: (2E)-5-methyl-3-phenyl-2-(4-phenyl-3-propylsulfanyl-1H-1,2,4-triazol-5-ylidene)indole Traditional Name: (2E)-5-methyl-3-phenyl-2-[4-phenyl-3-(propylthio)-1H-1,2,4-triazol-5-ylidene]indole Formula: C26H24N4S MolecularWeight: 424.56056

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NNC(=C2C(=C3C=C(C=CC3=N2)C)C4=CC=CC=C4)N1C5=CC=CC=C5

Isomeric SMILES

CCCSC1=NN/C(=C/2\C(=C3C=C(C=CC3=N2)C)C4=CC=CC=C4)/N1C5=CC=CC=C5

InChI

InChI=1S/C26H24N4S/c1-3-16-31-26-29-28-25(30(26)20-12-8-5-9-13-20)24-23(19-10-6-4-7-11-19)21-17-18(2)14-15-22(21)27-24/h4-15,17,28H,3,16H2,1-2H3/b25-24-