N-(2,3-dimethylphenyl)-2-[isoquinolin-5-ylsulfonyl-(4-methoxyphenyl)amino]ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-[isoquinolin-5-ylsulfonyl-(4-methoxyphenyl)amino]ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-[N-(5-isoquinolylsulfonyl)-4-methoxy-anilino]acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[N-(5-isoquinolinylsulfonyl)-4-methoxyanilino]acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-(N-isoquinolin-5-ylsulfonyl-4-methoxyanilino)acetamide Traditional Name: N-(2,3-dimethylphenyl)-2-[N-(5-isoquinolylsulfonyl)-4-methoxy-anilino]acetamide Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CN(C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=CC4=C3C=CN=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CN(C2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=CC4=C3C=CN=C4)C

InChI

InChI=1S/C26H25N3O4S/c1-18-6-4-8-24(19(18)2)28-26(30)17-29(21-10-12-22(33-3)13-11-21)34(31,32)25-9-5-7-20-16-27-15-14-23(20)25/h4-16H,17H2,1-3H3,(H,28,30)