N-cyclohexyl-2-[isoquinolin-5-ylsulfonyl-(4-methoxyphenyl)amino]ethanamide

Systemtic Name: N-cyclohexyl-2-[isoquinolin-5-ylsulfonyl-(4-methoxyphenyl)amino]ethanamide Openeye Name: N-cyclohexyl-2-[N-(5-isoquinolylsulfonyl)-4-methoxy-anilino]acetamide CAS Name: N-cyclohexyl-2-[N-(5-isoquinolinylsulfonyl)-4-methoxyanilino]acetamide IUPAC Name: N-cyclohexyl-2-(N-isoquinolin-5-ylsulfonyl-4-methoxyanilino)acetamide Traditional Name: N-cyclohexyl-2-[N-(5-isoquinolylsulfonyl)-4-methoxy-anilino]acetamide Formula: C24H27N3O4S MolecularWeight: 453.55388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC(=O)NC2CCCCC2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

COC1=CC=C(C=C1)N(CC(=O)NC2CCCCC2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C24H27N3O4S/c1-31-21-12-10-20(11-13-21)27(17-24(28)26-19-7-3-2-4-8-19)32(29,30)23-9-5-6-18-16-25-15-14-22(18)23/h5-6,9-16,19H,2-4,7-8,17H2,1H3,(H,26,28)