2-[phenyl(phenylsulfanyl)methyl]-1-[(2,4,6-trimethylphenyl)methyl]benzimidazole

Systemtic Name: 2-[phenyl(phenylsulfanyl)methyl]-1-[(2,4,6-trimethylphenyl)methyl]benzimidazole Openeye Name: 2-[phenyl(phenylsulfanyl)methyl]-1-[(2,4,6-trimethylphenyl)methyl]benzimidazole CAS Name: 2-[phenyl-(phenylthio)methyl]-1-[(2,4,6-trimethylphenyl)methyl]benzimidazole IUPAC Name: 2-[phenyl(phenylsulfanyl)methyl]-1-[(2,4,6-trimethylphenyl)methyl]benzimidazole Traditional Name: 2-[phenyl-(phenylthio)methyl]-1-(2,4,6-trimethylbenzyl)benzimidazole Formula: C30H28N2S MolecularWeight: 448.62172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)CN2C3=CC=CC=C3N=C2C(C4=CC=CC=C4)SC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)CN2C3=CC=CC=C3N=C2C(C4=CC=CC=C4)SC5=CC=CC=C5)C

InChI

InChI=1S/C30H28N2S/c1-21-18-22(2)26(23(3)19-21)20-32-28-17-11-10-16-27(28)31-30(32)29(24-12-6-4-7-13-24)33-25-14-8-5-9-15-25/h4-19,29H,20H2,1-3H3