5-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl-(phenylsulfonyl)amino]-N-cyclohexyl-1-benzothiophene-2-carboxamide

Systemtic Name: 5-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl-(phenylsulfonyl)amino]-N-cyclohexyl-1-benzothiophene-2-carboxamide Openeye Name: 5-[benzenesulfonyl-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]amino]-N-cyclohexyl-benzothiophene-2-carboxamide CAS Name: 5-[benzenesulfonyl-[[3-[(4-cyanophenyl)methyl]-4-imidazolyl]methyl]amino]-N-cyclohexyl-1-benzothiophene-2-carboxamide IUPAC Name: 5-[benzenesulfonyl-[[3-[(4-cyanophenyl)methyl]imidazol-4-yl]methyl]amino]-N-cyclohexyl-1-benzothiophene-2-carboxamide Traditional Name: 5-[besyl-[[3-(4-cyanobenzyl)imidazol-4-yl]methyl]amino]-N-cyclohexyl-benzothiophene-2-carboxamide Formula: C33H31N5O3S2 MolecularWeight: 609.76094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC3=C(S2)C=CC(=C3)N(CC4=CN=CN4CC5=CC=C(C=C5)C#N)S(=O)(=O)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC3=C(S2)C=CC(=C3)N(CC4=CN=CN4CC5=CC=C(C=C5)C#N)S(=O)(=O)C6=CC=CC=C6

InChI

InChI=1S/C33H31N5O3S2/c34-19-24-11-13-25(14-12-24)21-37-23-35-20-29(37)22-38(43(40,41)30-9-5-2-6-10-30)28-15-16-31-26(17-28)18-32(42-31)33(39)36-27-7-3-1-4-8-27/h2,5-6,9-18,20,23,27H,1,3-4,7-8,21-22H2,(H,36,39)