N-tert-butyl-2-[isoquinolin-5-ylsulfonyl(methyl)amino]ethanamide

Systemtic Name: N-tert-butyl-2-[isoquinolin-5-ylsulfonyl(methyl)amino]ethanamide Openeye Name: N-tert-butyl-2-[5-isoquinolylsulfonyl(methyl)amino]acetamide CAS Name: N-tert-butyl-2-[5-isoquinolinylsulfonyl(methyl)amino]acetamide IUPAC Name: N-tert-butyl-2-[isoquinolin-5-ylsulfonyl(methyl)amino]acetamide Traditional Name: N-tert-butyl-2-[5-isoquinolylsulfonyl(methyl)amino]acetamide Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C16H21N3O3S/c1-16(2,3)18-15(20)11-19(4)23(21,22)14-7-5-6-12-10-17-9-8-13(12)14/h5-10H,11H2,1-4H3,(H,18,20)