4-[[4-[(4-phenoxyphenyl)amino]pyrimidin-2-yl]amino]-N-(3-piperidin-1-ylpropyl)benzamide

Systemtic Name: 4-[[4-[(4-phenoxyphenyl)amino]pyrimidin-2-yl]amino]-N-(3-piperidin-1-ylpropyl)benzamide Openeye Name: 4-[[4-(4-phenoxyanilino)pyrimidin-2-yl]amino]-N-[3-(1-piperidyl)propyl]benzamide CAS Name: 4-[[4-(4-phenoxyanilino)-2-pyrimidinyl]amino]-N-[3-(1-piperidinyl)propyl]benzamide IUPAC Name: 4-[[4-(4-phenoxyanilino)pyrimidin-2-yl]amino]-N-(3-piperidin-1-ylpropyl)benzamide Traditional Name: 4-[[4-(4-phenoxyanilino)pyrimidin-2-yl]amino]-N-(3-piperidinopropyl)benzamide Formula: C31H34N6O2 MolecularWeight: 522.64066

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCNC(=O)C2=CC=C(C=C2)NC3=NC=CC(=N3)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)CCCNC(=O)C2=CC=C(C=C2)NC3=NC=CC(=N3)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C31H34N6O2/c38-30(32-19-7-23-37-21-5-2-6-22-37)24-10-12-26(13-11-24)35-31-33-20-18-29(36-31)34-25-14-16-28(17-15-25)39-27-8-3-1-4-9-27/h1,3-4,8-18,20H,2,5-7,19,21-23H2,(H,32,38)(H2,33,34,35,36)