N-{1-[(5-{2-[(4-cyanophenyl)amino]-4-(propylamino)pyrimidin-5-yl}pent-4-yn-1-yl)carbamoyl]ethyl}-4-(dimethylamino)-N-methylbut-2-enamide

CAS: 1472797-69-5

Formula: C29H38N8O2

SMILES: CCCNC1=NC(NC2=CC=C(C=C2)C#N)=NC=C1C#CCCCNC(=O)C(C)N(C)C(=O)C=CCN(C)C

IUPAC: N-{1-[(5-{2-[(4-cyanophenyl)amino]-4-(propylamino)pyrimidin-5-yl}pent-4-yn-1-yl)carbamoyl]ethyl}-4-(dimethylamino)-N-methylbut-2-enamide

InChI: InChI=1/C29H38N8O2/c1-6-17-31-27-24(21-33-29(35-27)34-25-15-13-23(20-30)14-16-25)11-8-7-9-18-32-28(39)22(2)37(5)26(38)12-10-19-36(3)4/h10,12-16,21-22H,6-7,9,17-19H2,1-5H3,(H,32,39)(H2,31,33,34,35)

Composition: C (65.64%), H (7.22%), N (21.12%), O (6.03%)

Molar Mass: 530.677

Atom Count: 77

Heavy Atom Count: 39