4-(5-cyano-7-propan-2-yl-1,3-benzoxazol-2-yl)-N-[[1-(2-phenylpyrimidin-4-yl)piperidin-4-yl]methyl]benzamide

Systemtic Name: 4-(5-cyano-7-propan-2-yl-1,3-benzoxazol-2-yl)-N-[[1-(2-phenylpyrimidin-4-yl)piperidin-4-yl]methyl]benzamide Openeye Name: 4-(5-cyano-7-isopropyl-1,3-benzoxazol-2-yl)-N-[[1-(2-phenylpyrimidin-4-yl)-4-piperidyl]methyl]benzamide CAS Name: 4-(5-cyano-7-propan-2-yl-1,3-benzoxazol-2-yl)-N-[[1-(2-phenyl-4-pyrimidinyl)-4-piperidinyl]methyl]benzamide IUPAC Name: 4-(5-cyano-7-propan-2-yl-1,3-benzoxazol-2-yl)-N-[[1-(2-phenylpyrimidin-4-yl)piperidin-4-yl]methyl]benzamide Traditional Name: 4-(5-cyano-7-isopropyl-1,3-benzoxazol-2-yl)-N-[[1-(2-phenylpyrimidin-4-yl)-4-piperidyl]methyl]benzamide Formula: C34H32N6O2 MolecularWeight: 556.65688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC(=C1)C#N)N=C(O2)C3=CC=C(C=C3)C(=O)NCC4CCN(CC4)C5=NC(=NC=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C)C1=C2C(=CC(=C1)C#N)N=C(O2)C3=CC=C(C=C3)C(=O)NCC4CCN(CC4)C5=NC(=NC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H32N6O2/c1-22(2)28-18-24(20-35)19-29-31(28)42-34(38-29)27-10-8-26(9-11-27)33(41)37-21-23-13-16-40(17-14-23)30-12-15-36-32(39-30)25-6-4-3-5-7-25/h3-12,15,18-19,22-23H,13-14,16-17,21H2,1-2H3,(H,37,41)