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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O3S/c1-14-7-8-18(15(2)11-14)22-20(24)13-23(3)27(25,26)19-6-4-5-16-12-21-10-9-17(16)19/h4-12H,13H2,1-3H3,(H,22,24)