N-(4-ethylphenyl)-2-[isoquinolin-5-ylsulfonyl(propyl)amino]ethanamide

Systemtic Name: N-(4-ethylphenyl)-2-[isoquinolin-5-ylsulfonyl(propyl)amino]ethanamide Openeye Name: N-(4-ethylphenyl)-2-[5-isoquinolylsulfonyl(propyl)amino]acetamide CAS Name: N-(4-ethylphenyl)-2-[5-isoquinolinylsulfonyl(propyl)amino]acetamide IUPAC Name: N-(4-ethylphenyl)-2-[isoquinolin-5-ylsulfonyl(propyl)amino]acetamide Traditional Name: N-(4-ethylphenyl)-2-[5-isoquinolylsulfonyl(propyl)amino]acetamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O3S/c1-3-14-25(16-22(26)24-19-10-8-17(4-2)9-11-19)29(27,28)21-7-5-6-18-15-23-13-12-20(18)21/h5-13,15H,3-4,14,16H2,1-2H3,(H,24,26)