[4-[(5-chloranyl-6-ethyl-pyrimidin-4-yl)amino]cyclohexyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: [4-[(5-chloranyl-6-ethyl-pyrimidin-4-yl)amino]cyclohexyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: [4-[(5-chloro-6-ethyl-pyrimidin-4-yl)amino]cyclohexyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [4-[(5-chloro-6-ethyl-4-pyrimidinyl)amino]cyclohexyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [4-[(5-chloro-6-ethylpyrimidin-4-yl)amino]cyclohexyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [4-[(5-chloro-6-ethyl-pyrimidin-4-yl)amino]cyclohexyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C22H27ClN4O MolecularWeight: 398.92898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC=N1)NC2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3)Cl

Isomeric SMILES

CCC1=C(C(=NC=N1)NC2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3)Cl

InChI

InChI=1S/C22H27ClN4O/c1-2-19-20(23)21(25-14-24-19)26-18-9-7-16(8-10-18)22(28)27-12-11-15-5-3-4-6-17(15)13-27/h3-6,14,16,18H,2,7-13H2,1H3,(H,24,25,26)