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

Systemtic Name: N-(3-acetamidophenyl)-2-[isoquinolin-5-ylsulfonyl(propyl)amino]ethanamide Openeye Name: N-(3-acetamidophenyl)-2-[5-isoquinolylsulfonyl(propyl)amino]acetamide CAS Name: N-(3-acetamidophenyl)-2-[5-isoquinolinylsulfonyl(propyl)amino]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-[isoquinolin-5-ylsulfonyl(propyl)amino]acetamide Traditional Name: N-(3-acetamidophenyl)-2-[5-isoquinolylsulfonyl(propyl)amino]acetamide Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O4S/c1-3-12-26(15-22(28)25-19-8-5-7-18(13-19)24-16(2)27)31(29,30)21-9-4-6-17-14-23-11-10-20(17)21/h4-11,13-14H,3,12,15H2,1-2H3,(H,24,27)(H,25,28)