5-[5-[(4-chlorophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]-2,3-dimethyl-1H-indole

Systemtic Name: 5-[5-[(4-chlorophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]-2,3-dimethyl-1H-indole Openeye Name: 5-[5-[(4-chlorophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]-2,3-dimethyl-1H-indole CAS Name: 5-[5-[(4-chlorophenyl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]-2,3-dimethyl-1H-indole IUPAC Name: 5-[5-[(4-chlorophenyl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]-2,3-dimethyl-1H-indole Traditional Name: 5-[5-[(4-chlorobenzyl)thio]-4-phenyl-1,2,4-triazol-3-yl]-2,3-dimethyl-1H-indole Formula: C25H21ClN4S MolecularWeight: 444.97904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C3=NN=C(N3C4=CC=CC=C4)SCC5=CC=C(C=C5)Cl)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C3=NN=C(N3C4=CC=CC=C4)SCC5=CC=C(C=C5)Cl)C

InChI

InChI=1S/C25H21ClN4S/c1-16-17(2)27-23-13-10-19(14-22(16)23)24-28-29-25(30(24)21-6-4-3-5-7-21)31-15-18-8-11-20(26)12-9-18/h3-14,27H,15H2,1-2H3