2-[(4-tert-butylphenyl)methylsulfanyl]-5-chloranyl-1-(phenylmethyl)benzimidazole

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-5-chloranyl-1-(phenylmethyl)benzimidazole Openeye Name: 1-benzyl-2-[(4-tert-butylphenyl)methylsulfanyl]-5-chloro-benzimidazole CAS Name: 2-[(4-tert-butylphenyl)methylthio]-5-chloro-1-(phenylmethyl)benzimidazole IUPAC Name: 1-benzyl-2-[(4-tert-butylphenyl)methylsulfanyl]-5-chlorobenzimidazole Traditional Name: 1-benzyl-2-[(4-tert-butylbenzyl)thio]-5-chloro-benzimidazole Formula: C25H25ClN2S MolecularWeight: 420.9974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl

InChI

InChI=1S/C25H25ClN2S/c1-25(2,3)20-11-9-19(10-12-20)17-29-24-27-22-15-21(26)13-14-23(22)28(24)16-18-7-5-4-6-8-18/h4-15H,16-17H2,1-3H3