4-chloranyl-N-(2-cyclohexyl-2-phenyl-ethyl)-1-pyrimidin-2-yl-indole-3-carboxamide

Systemtic Name: 4-chloranyl-N-(2-cyclohexyl-2-phenyl-ethyl)-1-pyrimidin-2-yl-indole-3-carboxamide Openeye Name: 4-chloro-N-(2-cyclohexyl-2-phenyl-ethyl)-1-pyrimidin-2-yl-indole-3-carboxamide CAS Name: 4-chloro-N-(2-cyclohexyl-2-phenylethyl)-1-(2-pyrimidinyl)-3-indolecarboxamide IUPAC Name: 4-chloro-N-(2-cyclohexyl-2-phenylethyl)-1-pyrimidin-2-ylindole-3-carboxamide Traditional Name: 4-chloro-N-(2-cyclohexyl-2-phenyl-ethyl)-1-(2-pyrimidyl)indole-3-carboxamide Formula: C27H27ClN4O MolecularWeight: 458.98248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CNC(=O)C2=CN(C3=C2C(=CC=C3)Cl)C4=NC=CC=N4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)C(CNC(=O)C2=CN(C3=C2C(=CC=C3)Cl)C4=NC=CC=N4)C5=CC=CC=C5

InChI

InChI=1S/C27H27ClN4O/c28-23-13-7-14-24-25(23)22(18-32(24)27-29-15-8-16-30-27)26(33)31-17-21(19-9-3-1-4-10-19)20-11-5-2-6-12-20/h1,3-4,7-10,13-16,18,20-21H,2,5-6,11-12,17H2,(H,31,33)