5-[4-(phenylsulfonyl)phenyl]sulfanyl-5,6,7,8-tetrahydro-1H-benzo[f]benzimidazol-2-amine

Systemtic Name: 5-[4-(phenylsulfonyl)phenyl]sulfanyl-5,6,7,8-tetrahydro-1H-benzo[f]benzimidazol-2-amine Openeye Name: 5-[4-(benzenesulfonyl)phenyl]sulfanyl-5,6,7,8-tetrahydro-1H-benzo[f]benzimidazol-2-amine CAS Name: 5-[[4-(benzenesulfonyl)phenyl]thio]-5,6,7,8-tetrahydro-1H-benzo[f]benzimidazol-2-amine IUPAC Name: 5-[4-(benzenesulfonyl)phenyl]sulfanyl-5,6,7,8-tetrahydro-1H-benzo[f]benzimidazol-2-amine Traditional Name: [5-[(4-besylphenyl)thio]-5,6,7,8-tetrahydro-1H-benzo[f]benzimidazol-2-yl]amine Formula: C23H21N3O2S2 MolecularWeight: 435.56174

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC3=C(C=C2C1)NC(=N3)N)SC4=CC=C(C=C4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CC(C2=CC3=C(C=C2C1)NC(=N3)N)SC4=CC=C(C=C4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C23H21N3O2S2/c24-23-25-20-13-15-5-4-8-22(19(15)14-21(20)26-23)29-16-9-11-18(12-10-16)30(27,28)17-6-2-1-3-7-17/h1-3,6-7,9-14,22H,4-5,8H2,(H3,24,25,26)