2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]ethanamide

Systemtic Name: 2-[(1R)-2-ethanoyl-1H-isoquinolin-1-yl]-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]ethanamide Openeye Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]acetamide CAS Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]acetamide IUPAC Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]acetamide Traditional Name: 2-[(1R)-2-acetyl-1H-isoquinolin-1-yl]-N-[4-(4-methylpiperidino)sulfonylphenyl]acetamide Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3C4=CC=CC=C4C=CN3C(=O)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C[C@@H]3C4=CC=CC=C4C=CN3C(=O)C

InChI

InChI=1S/C25H29N3O4S/c1-18-11-14-27(15-12-18)33(31,32)22-9-7-21(8-10-22)26-25(30)17-24-23-6-4-3-5-20(23)13-16-28(24)19(2)29/h3-10,13,16,18,24H,11-12,14-15,17H2,1-2H3,(H,26,30)/t24-/m1/s1