2-[azanyl(isoquinolin-6-yl)amino]-2-(3-ethoxy-4-propan-2-yloxy-phenyl)-N-(4-hydroxyphenyl)sulfonyl-ethanamide

Systemtic Name: 2-[azanyl(isoquinolin-6-yl)amino]-2-(3-ethoxy-4-propan-2-yloxy-phenyl)-N-(4-hydroxyphenyl)sulfonyl-ethanamide Openeye Name: 2-[amino(6-isoquinolyl)amino]-2-(3-ethoxy-4-isopropoxy-phenyl)-N-(4-hydroxyphenyl)sulfonyl-acetamide CAS Name: 2-[amino(6-isoquinolinyl)amino]-2-(3-ethoxy-4-propan-2-yloxyphenyl)-N-(4-hydroxyphenyl)sulfonylacetamide IUPAC Name: 2-[amino(isoquinolin-6-yl)amino]-2-(3-ethoxy-4-propan-2-yloxyphenyl)-N-(4-hydroxyphenyl)sulfonylacetamide Traditional Name: 2-[amino(6-isoquinolyl)amino]-2-(3-ethoxy-4-isopropoxy-phenyl)-N-(4-hydroxyphenyl)sulfonyl-acetamide Formula: C28H30N4O6S MolecularWeight: 550.626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C(=O)NS(=O)(=O)C2=CC=C(C=C2)O)N(C3=CC4=C(C=C3)C=NC=C4)N)OC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C(=O)NS(=O)(=O)C2=CC=C(C=C2)O)N(C3=CC4=C(C=C3)C=NC=C4)N)OC(C)C

InChI

InChI=1S/C28H30N4O6S/c1-4-37-26-16-20(6-12-25(26)38-18(2)3)27(28(34)31-39(35,36)24-10-8-23(33)9-11-24)32(29)22-7-5-21-17-30-14-13-19(21)15-22/h5-18,27,33H,4,29H2,1-3H3,(H,31,34)