3-[(4-methylphenyl)sulfonylamino]-N-(5-piperidin-1-ylisoquinolin-8-yl)propanamide

Systemtic Name: 3-[(4-methylphenyl)sulfonylamino]-N-(5-piperidin-1-ylisoquinolin-8-yl)propanamide Openeye Name: N-[5-(1-piperidyl)-8-isoquinolyl]-3-(p-tolylsulfonylamino)propanamide CAS Name: 3-[(4-methylphenyl)sulfonylamino]-N-[5-(1-piperidinyl)-8-isoquinolinyl]propanamide IUPAC Name: 3-[(4-methylphenyl)sulfonylamino]-N-(5-piperidin-1-ylisoquinolin-8-yl)propanamide Traditional Name: N-(5-piperidino-8-isoquinolyl)-3-(tosylamino)propionamide Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4

InChI

InChI=1S/C24H28N4O3S/c1-18-5-7-19(8-6-18)32(30,31)26-14-12-24(29)27-22-9-10-23(28-15-3-2-4-16-28)20-11-13-25-17-21(20)22/h5-11,13,17,26H,2-4,12,14-16H2,1H3,(H,27,29)