5-methylsulfonyl-N-[1-(7H-purin-6-yl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide

Systemtic Name: 5-methylsulfonyl-N-[1-(7H-purin-6-yl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide Openeye Name: 5-methylsulfonyl-N-[1-(7H-purin-6-yl)-4-piperidyl]indoline-1-carboxamide CAS Name: 5-methylsulfonyl-N-[1-(7H-purin-6-yl)-4-piperidinyl]-2,3-dihydroindole-1-carboxamide IUPAC Name: 5-methylsulfonyl-N-[1-(7H-purin-6-yl)piperidin-4-yl]-2,3-dihydroindole-1-carboxamide Traditional Name: 5-mesyl-N-[1-(7H-purin-6-yl)-4-piperidyl]indoline-1-carboxamide Formula: C20H23N7O3S MolecularWeight: 441.50672

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N(CC2)C(=O)NC3CCN(CC3)C4=NC=NC5=C4NC=N5

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N(CC2)C(=O)NC3CCN(CC3)C4=NC=NC5=C4NC=N5

InChI

InChI=1S/C20H23N7O3S/c1-31(29,30)15-2-3-16-13(10-15)4-9-27(16)20(28)25-14-5-7-26(8-6-14)19-17-18(22-11-21-17)23-12-24-19/h2-3,10-12,14H,4-9H2,1H3,(H,25,28)(H,21,22,23,24)