N-[6,7-dimethoxy-1-(3-propan-2-yloxyphenyl)carbonyl-isoquinolin-4-yl]pyrazine-2-carboxamide

Systemtic Name: N-[6,7-dimethoxy-1-(3-propan-2-yloxyphenyl)carbonyl-isoquinolin-4-yl]pyrazine-2-carboxamide Openeye Name: N-[1-(3-isopropoxybenzoyl)-6,7-dimethoxy-4-isoquinolyl]pyrazine-2-carboxamide CAS Name: N-[6,7-dimethoxy-1-[oxo-(3-propan-2-yloxyphenyl)methyl]-4-isoquinolinyl]-2-pyrazinecarboxamide IUPAC Name: N-[6,7-dimethoxy-1-(3-propan-2-yloxybenzoyl)isoquinolin-4-yl]pyrazine-2-carboxamide Traditional Name: N-[1-(3-isopropoxybenzoyl)-6,7-dimethoxy-4-isoquinolyl]pyrazinamide Formula: C26H24N4O5 MolecularWeight: 472.49256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)C2=NC=C(C3=CC(=C(C=C32)OC)OC)NC(=O)C4=NC=CN=C4

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)C2=NC=C(C3=CC(=C(C=C32)OC)OC)NC(=O)C4=NC=CN=C4

InChI

InChI=1S/C26H24N4O5/c1-15(2)35-17-7-5-6-16(10-17)25(31)24-19-12-23(34-4)22(33-3)11-18(19)20(14-29-24)30-26(32)21-13-27-8-9-28-21/h5-15H,1-4H3,(H,30,32)