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

Systemtic Name: 4-(5-cyano-7-propan-2-yl-1,3-benzoxazol-2-yl)-N-[[1-(2-piperidin-1-ylpyrimidin-4-yl)piperidin-4-yl]methyl]benzamide Openeye Name: 4-(5-cyano-7-isopropyl-1,3-benzoxazol-2-yl)-N-[[1-[2-(1-piperidyl)pyrimidin-4-yl]-4-piperidyl]methyl]benzamide CAS Name: 4-(5-cyano-7-propan-2-yl-1,3-benzoxazol-2-yl)-N-[[1-[2-(1-piperidinyl)-4-pyrimidinyl]-4-piperidinyl]methyl]benzamide IUPAC Name: 4-(5-cyano-7-propan-2-yl-1,3-benzoxazol-2-yl)-N-[[1-(2-piperidin-1-ylpyrimidin-4-yl)piperidin-4-yl]methyl]benzamide Traditional Name: 4-(5-cyano-7-isopropyl-1,3-benzoxazol-2-yl)-N-[[1-(2-piperidinopyrimidin-4-yl)-4-piperidyl]methyl]benzamide Formula: C33H37N7O2 MolecularWeight: 563.69258

Click to see the large picture

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)N6CCCCC6

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)N6CCCCC6

InChI

InChI=1S/C33H37N7O2/c1-22(2)27-18-24(20-34)19-28-30(27)42-32(37-28)26-8-6-25(7-9-26)31(41)36-21-23-11-16-39(17-12-23)29-10-13-35-33(38-29)40-14-4-3-5-15-40/h6-10,13,18-19,22-23H,3-5,11-12,14-17,21H2,1-2H3,(H,36,41)