2-[isoquinolin-5-ylsulfonyl(methyl)amino]-N-[(4-methylphenyl)methyl]ethanamide

Systemtic Name: 2-[isoquinolin-5-ylsulfonyl(methyl)amino]-N-[(4-methylphenyl)methyl]ethanamide Openeye Name: 2-[5-isoquinolylsulfonyl(methyl)amino]-N-(p-tolylmethyl)acetamide CAS Name: 2-[5-isoquinolinylsulfonyl(methyl)amino]-N-[(4-methylphenyl)methyl]acetamide IUPAC Name: 2-[isoquinolin-5-ylsulfonyl(methyl)amino]-N-[(4-methylphenyl)methyl]acetamide Traditional Name: 2-[5-isoquinolylsulfonyl(methyl)amino]-N-(4-methylbenzyl)acetamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CN(C)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CN(C)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C20H21N3O3S/c1-15-6-8-16(9-7-15)12-22-20(24)14-23(2)27(25,26)19-5-3-4-17-13-21-11-10-18(17)19/h3-11,13H,12,14H2,1-2H3,(H,22,24)