(1-methylsulfonyl-2,3-dihydroindol-5-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (1-methylsulfonyl-2,3-dihydroindol-5-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (1-methylsulfonylindolin-5-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (1-methylsulfonyl-2,3-dihydroindol-5-yl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (1-methylsulfonyl-2,3-dihydroindol-5-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (1-mesylindolin-5-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C18H21N5O3S MolecularWeight: 387.45604

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CS(=O)(=O)N1CCC2=C1C=CC(=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C18H21N5O3S/c1-27(25,26)23-8-5-14-13-15(3-4-16(14)23)17(24)21-9-11-22(12-10-21)18-19-6-2-7-20-18/h2-4,6-7,13H,5,8-12H2,1H3