(2R)-2-acetamido-N-[2-[4-(pyrimidin-2-ylamino)butylcarbamoyl]-1,3-dihydroinden-2-yl]pentanediamide

Systemtic Name: (2R)-2-acetamido-N-[2-[4-(pyrimidin-2-ylamino)butylcarbamoyl]-1,3-dihydroinden-2-yl]pentanediamide Openeye Name: (2R)-2-acetamido-N-[2-[4-(pyrimidin-2-ylamino)butylcarbamoyl]indan-2-yl]pentanediamide CAS Name: (2R)-2-acetamido-N-[2-[oxo-[4-(2-pyrimidinylamino)butylamino]methyl]-1,3-dihydroinden-2-yl]pentanediamide IUPAC Name: (2R)-2-acetamido-N-[2-[4-(pyrimidin-2-ylamino)butylcarbamoyl]-1,3-dihydroinden-2-yl]pentanediamide Traditional Name: (2R)-2-acetamido-N-[2-[4-(2-pyrimidylamino)butylcarbamoyl]indan-2-yl]glutaramide Formula: C25H33N7O4 MolecularWeight: 495.57402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCC(=O)N)C(=O)NC1(CC2=CC=CC=C2C1)C(=O)NCCCCNC3=NC=CC=N3

Isomeric SMILES

CC(=O)N[C@H](CCC(=O)N)C(=O)NC1(CC2=CC=CC=C2C1)C(=O)NCCCCNC3=NC=CC=N3

InChI

InChI=1S/C25H33N7O4/c1-17(33)31-20(9-10-21(26)34)22(35)32-25(15-18-7-2-3-8-19(18)16-25)23(36)27-11-4-5-12-28-24-29-13-6-14-30-24/h2-3,6-8,13-14,20H,4-5,9-12,15-16H2,1H3,(H2,26,34)(H,27,36)(H,31,33)(H,32,35)(H,28,29,30)/t20-/m1/s1