N-[1-(3-acetamidophenyl)ethyl]-2-[(1-azanylisoquinolin-6-yl)amino]-2-(3-ethoxy-4-propan-2-yloxy-phenyl)ethanamide

Systemtic Name: N-[1-(3-acetamidophenyl)ethyl]-2-[(1-azanylisoquinolin-6-yl)amino]-2-(3-ethoxy-4-propan-2-yloxy-phenyl)ethanamide Openeye Name: N-[1-(3-acetamidophenyl)ethyl]-2-[(1-amino-6-isoquinolyl)amino]-2-(3-ethoxy-4-isopropoxy-phenyl)acetamide CAS Name: N-[1-(3-acetamidophenyl)ethyl]-2-[(1-amino-6-isoquinolinyl)amino]-2-(3-ethoxy-4-propan-2-yloxyphenyl)acetamide IUPAC Name: N-[1-(3-acetamidophenyl)ethyl]-2-[(1-aminoisoquinolin-6-yl)amino]-2-(3-ethoxy-4-propan-2-yloxyphenyl)acetamide Traditional Name: N-[1-(3-acetamidophenyl)ethyl]-2-[(1-amino-6-isoquinolyl)amino]-2-(3-ethoxy-4-isopropoxy-phenyl)acetamide Formula: C32H37N5O4 MolecularWeight: 555.66728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C(=O)NC(C)C2=CC(=CC=C2)NC(=O)C)NC3=CC4=C(C=C3)C(=NC=C4)N)OC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C(=O)NC(C)C2=CC(=CC=C2)NC(=O)C)NC3=CC4=C(C=C3)C(=NC=C4)N)OC(C)C

InChI

InChI=1S/C32H37N5O4/c1-6-40-29-18-24(10-13-28(29)41-19(2)3)30(37-26-11-12-27-23(17-26)14-15-34-31(27)33)32(39)35-20(4)22-8-7-9-25(16-22)36-21(5)38/h7-20,30,37H,6H2,1-5H3,(H2,33,34)(H,35,39)(H,36,38)