2-[isoquinolin-5-ylsulfonyl(2-methoxyethyl)amino]-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-[isoquinolin-5-ylsulfonyl(2-methoxyethyl)amino]-N-(2-methylphenyl)ethanamide Openeye Name: 2-[5-isoquinolylsulfonyl(2-methoxyethyl)amino]-N-(o-tolyl)acetamide CAS Name: 2-[5-isoquinolinylsulfonyl(2-methoxyethyl)amino]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[isoquinolin-5-ylsulfonyl(2-methoxyethyl)amino]-N-(2-methylphenyl)acetamide Traditional Name: 2-[5-isoquinolylsulfonyl(2-methoxyethyl)amino]-N-(o-tolyl)acetamide Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CN(CCOC)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CN(CCOC)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C21H23N3O4S/c1-16-6-3-4-8-19(16)23-21(25)15-24(12-13-28-2)29(26,27)20-9-5-7-17-14-22-11-10-18(17)20/h3-11,14H,12-13,15H2,1-2H3,(H,23,25)