2-methyl-3-[[4-(phenylmethyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1H-indole

Systemtic Name: 2-methyl-3-[[4-(phenylmethyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1H-indole Openeye Name: 3-[(4-benzyl-5-benzylsulfanyl-1,2,4-triazol-3-yl)methyl]-2-methyl-1H-indole CAS Name: 2-methyl-3-[[4-(phenylmethyl)-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methyl]-1H-indole IUPAC Name: 3-[(4-benzyl-5-benzylsulfanyl-1,2,4-triazol-3-yl)methyl]-2-methyl-1H-indole Traditional Name: 3-[[4-benzyl-5-(benzylthio)-1,2,4-triazol-3-yl]methyl]-2-methyl-1H-indole Formula: C26H24N4S MolecularWeight: 424.56056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)CC3=NN=C(N3CC4=CC=CC=C4)SCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)CC3=NN=C(N3CC4=CC=CC=C4)SCC5=CC=CC=C5

InChI

InChI=1S/C26H24N4S/c1-19-23(22-14-8-9-15-24(22)27-19)16-25-28-29-26(31-18-21-12-6-3-7-13-21)30(25)17-20-10-4-2-5-11-20/h2-15,27H,16-18H2,1H3