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

Systemtic Name: 2-[(1-azanylisoquinolin-6-yl)amino]-2-(3-ethoxy-4-propan-2-yloxy-phenyl)-N-propan-2-ylsulfonyl-ethanamide Openeye Name: 2-[(1-amino-6-isoquinolyl)amino]-2-(3-ethoxy-4-isopropoxy-phenyl)-N-isopropylsulfonyl-acetamide CAS Name: 2-[(1-amino-6-isoquinolinyl)amino]-2-(3-ethoxy-4-propan-2-yloxyphenyl)-N-propan-2-ylsulfonylacetamide IUPAC Name: 2-[(1-aminoisoquinolin-6-yl)amino]-2-(3-ethoxy-4-propan-2-yloxyphenyl)-N-propan-2-ylsulfonylacetamide Traditional Name: 2-[(1-amino-6-isoquinolyl)amino]-2-(3-ethoxy-4-isopropoxy-phenyl)-N-isopropylsulfonyl-acetamide Formula: C25H32N4O5S MolecularWeight: 500.61038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C(=O)NS(=O)(=O)C(C)C)NC2=CC3=C(C=C2)C(=NC=C3)N)OC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C(=O)NS(=O)(=O)C(C)C)NC2=CC3=C(C=C2)C(=NC=C3)N)OC(C)C

InChI

InChI=1S/C25H32N4O5S/c1-6-33-22-14-18(7-10-21(22)34-15(2)3)23(25(30)29-35(31,32)16(4)5)28-19-8-9-20-17(13-19)11-12-27-24(20)26/h7-16,23,28H,6H2,1-5H3,(H2,26,27)(H,29,30)