N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-[2-(5-morpholin-4-ylpentylamino)pyrimidin-4-yl]benzamide

Systemtic Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-[2-(5-morpholin-4-ylpentylamino)pyrimidin-4-yl]benzamide Openeye Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-[2-(5-morpholinopentylamino)pyrimidin-4-yl]benzamide CAS Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-[2-[5-(4-morpholinyl)pentylamino]-4-pyrimidinyl]benzamide IUPAC Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-[2-(5-morpholin-4-ylpentylamino)pyrimidin-4-yl]benzamide Traditional Name: N-[2-(3-cyano-1H-indol-5-yl)ethyl]-4-[2-(5-morpholinopentylamino)pyrimidin-4-yl]benzamide Formula: C31H35N7O2 MolecularWeight: 537.6553

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCCCNC2=NC=CC(=N2)C3=CC=C(C=C3)C(=O)NCCC4=CC5=C(C=C4)NC=C5C#N

Isomeric SMILES

C1COCCN1CCCCCNC2=NC=CC(=N2)C3=CC=C(C=C3)C(=O)NCCC4=CC5=C(C=C4)NC=C5C#N

InChI

InChI=1S/C31H35N7O2/c32-21-26-22-36-29-9-4-23(20-27(26)29)10-13-33-30(39)25-7-5-24(6-8-25)28-11-14-35-31(37-28)34-12-2-1-3-15-38-16-18-40-19-17-38/h4-9,11,14,20,22,36H,1-3,10,12-13,15-19H2,(H,33,39)(H,34,35,37)