N-(3-acetamidophenyl)-2-[isoquinolin-5-ylsulfonyl(2-methoxyethyl)amino]ethanamide

Systemtic Name: N-(3-acetamidophenyl)-2-[isoquinolin-5-ylsulfonyl(2-methoxyethyl)amino]ethanamide Openeye Name: N-(3-acetamidophenyl)-2-[5-isoquinolylsulfonyl(2-methoxyethyl)amino]acetamide CAS Name: N-(3-acetamidophenyl)-2-[5-isoquinolinylsulfonyl(2-methoxyethyl)amino]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-[isoquinolin-5-ylsulfonyl(2-methoxyethyl)amino]acetamide Traditional Name: N-(3-acetamidophenyl)-2-[5-isoquinolylsulfonyl(2-methoxyethyl)amino]acetamide Formula: C22H24N4O5S MolecularWeight: 456.51476

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)CN(CCOC)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)CN(CCOC)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C22H24N4O5S/c1-16(27)24-18-6-4-7-19(13-18)25-22(28)15-26(11-12-31-2)32(29,30)21-8-3-5-17-14-23-10-9-20(17)21/h3-10,13-14H,11-12,15H2,1-2H3,(H,24,27)(H,25,28)