2-(benzimidazol-1-yl)-1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-(benzimidazol-1-yl)-1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 2-(benzimidazol-1-yl)-1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]propan-1-one CAS Name: 2-(1-benzimidazolyl)-1-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: 2-(benzimidazol-1-yl)-1-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 2-(benzimidazol-1-yl)-1-[4-(4-tert-butylphenyl)sulfonylpiperazino]propan-1-one Formula: C24H30N4O3S MolecularWeight: 454.585

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)N3C=NC4=CC=CC=C43

Isomeric SMILES

CC(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)(C)C)N3C=NC4=CC=CC=C43

InChI

InChI=1S/C24H30N4O3S/c1-18(28-17-25-21-7-5-6-8-22(21)28)23(29)26-13-15-27(16-14-26)32(30,31)20-11-9-19(10-12-20)24(2,3)4/h5-12,17-18H,13-16H2,1-4H3