6-(3-cyclohexyl-2-ethynyl-5-phenyl-imidazol-4-yl)-1-propan-2-ylsulfonyl-benzimidazol-2-amine

Systemtic Name: 6-(3-cyclohexyl-2-ethynyl-5-phenyl-imidazol-4-yl)-1-propan-2-ylsulfonyl-benzimidazol-2-amine Openeye Name: 6-(3-cyclohexyl-2-ethynyl-5-phenyl-imidazol-4-yl)-1-isopropylsulfonyl-benzimidazol-2-amine CAS Name: 6-(3-cyclohexyl-2-ethynyl-5-phenyl-4-imidazolyl)-1-propan-2-ylsulfonyl-2-benzimidazolamine IUPAC Name: 6-(3-cyclohexyl-2-ethynyl-5-phenylimidazol-4-yl)-1-propan-2-ylsulfonylbenzimidazol-2-amine Traditional Name: [6-(3-cyclohexyl-2-ethynyl-5-phenyl-imidazol-4-yl)-1-isopropylsulfonyl-benzimidazol-2-yl]amine Formula: C27H29N5O2S MolecularWeight: 487.61646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C3=C(N=C(N3C4CCCCC4)C#C)C5=CC=CC=C5)N=C1N

Isomeric SMILES

CC(C)S(=O)(=O)N1C2=C(C=CC(=C2)C3=C(N=C(N3C4CCCCC4)C#C)C5=CC=CC=C5)N=C1N

InChI

InChI=1S/C27H29N5O2S/c1-4-24-30-25(19-11-7-5-8-12-19)26(31(24)21-13-9-6-10-14-21)20-15-16-22-23(17-20)32(27(28)29-22)35(33,34)18(2)3/h1,5,7-8,11-12,15-18,21H,6,9-10,13-14H2,2-3H3,(H2,28,29)