2-methyl-1-methylsulfonyl-N-(5-piperidin-1-ylisoquinolin-8-yl)-2,3-dihydroindole-5-carboxamide

Systemtic Name: 2-methyl-1-methylsulfonyl-N-(5-piperidin-1-ylisoquinolin-8-yl)-2,3-dihydroindole-5-carboxamide Openeye Name: 2-methyl-1-methylsulfonyl-N-[5-(1-piperidyl)-8-isoquinolyl]indoline-5-carboxamide CAS Name: 2-methyl-1-methylsulfonyl-N-[5-(1-piperidinyl)-8-isoquinolinyl]-2,3-dihydroindole-5-carboxamide IUPAC Name: 2-methyl-1-methylsulfonyl-N-(5-piperidin-1-ylisoquinolin-8-yl)-2,3-dihydroindole-5-carboxamide Traditional Name: 1-mesyl-2-methyl-N-(5-piperidino-8-isoquinolyl)indoline-5-carboxamide Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NC3=C4C=NC=CC4=C(C=C3)N5CCCCC5

Isomeric SMILES

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)NC3=C4C=NC=CC4=C(C=C3)N5CCCCC5

InChI

InChI=1S/C25H28N4O3S/c1-17-14-19-15-18(6-8-23(19)29(17)33(2,31)32)25(30)27-22-7-9-24(28-12-4-3-5-13-28)20-10-11-26-16-21(20)22/h6-11,15-17H,3-5,12-14H2,1-2H3,(H,27,30)