2-(2,3-dihydroindol-1-ylcarbonyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]cyclohexane-1-carboxamide

Systemtic Name: 2-(2,3-dihydroindol-1-ylcarbonyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]cyclohexane-1-carboxamide Openeye Name: 2-(indoline-1-carbonyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]cyclohexanecarboxamide CAS Name: 2-[2,3-dihydroindol-1-yl(oxo)methyl]-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-1-cyclohexanecarboxamide IUPAC Name: 2-(2,3-dihydroindole-1-carbonyl)-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]cyclohexane-1-carboxamide Traditional Name: 2-(indoline-1-carbonyl)-N-[3-[4-(2-pyrimidyl)piperazino]propyl]cyclohexanecarboxamide Formula: C27H36N6O2 MolecularWeight: 476.61374

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NCCCN2CCN(CC2)C3=NC=CC=N3)C(=O)N4CCC5=CC=CC=C54

Isomeric SMILES

C1CCC(C(C1)C(=O)NCCCN2CCN(CC2)C3=NC=CC=N3)C(=O)N4CCC5=CC=CC=C54

InChI

InChI=1S/C27H36N6O2/c34-25(28-14-6-15-31-17-19-32(20-18-31)27-29-12-5-13-30-27)22-8-2-3-9-23(22)26(35)33-16-11-21-7-1-4-10-24(21)33/h1,4-5,7,10,12-13,22-23H,2-3,6,8-9,11,14-20H2,(H,28,34)