N-[4-[1-(2-methylpropyl)-4-[2-[[3-(2-morpholin-4-ylethyl)phenyl]amino]pyrimidin-4-yl]pyrazol-3-yl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[1-(2-methylpropyl)-4-[2-[[3-(2-morpholin-4-ylethyl)phenyl]amino]pyrimidin-4-yl]pyrazol-3-yl]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[1-isobutyl-4-[2-[3-(2-morpholinoethyl)anilino]pyrimidin-4-yl]pyrazol-3-yl]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[1-(2-methylpropyl)-4-[2-[3-[2-(4-morpholinyl)ethyl]anilino]-4-pyrimidinyl]-3-pyrazolyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[1-(2-methylpropyl)-4-[2-[3-(2-morpholin-4-ylethyl)anilino]pyrimidin-4-yl]pyrazol-3-yl]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[1-isobutyl-4-[2-[3-(2-morpholinoethyl)anilino]pyrimidin-4-yl]pyrazol-3-yl]phenyl]cyclopropanecarboxamide Formula: C33H39N7O2 MolecularWeight: 565.70846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C(=N1)C2=CC=C(C=C2)NC(=O)C3CC3)C4=NC(=NC=C4)NC5=CC=CC(=C5)CCN6CCOCC6

Isomeric SMILES

CC(C)CN1C=C(C(=N1)C2=CC=C(C=C2)NC(=O)C3CC3)C4=NC(=NC=C4)NC5=CC=CC(=C5)CCN6CCOCC6

InChI

InChI=1S/C33H39N7O2/c1-23(2)21-40-22-29(31(38-40)25-8-10-27(11-9-25)35-32(41)26-6-7-26)30-12-14-34-33(37-30)36-28-5-3-4-24(20-28)13-15-39-16-18-42-19-17-39/h3-5,8-12,14,20,22-23,26H,6-7,13,15-19,21H2,1-2H3,(H,35,41)(H,34,36,37)