3-[(7-chloranyl-2-ethyl-quinazolin-4-yl)-cyclohexyl-amino]-N-propan-2-yl-propanamide

Systemtic Name: 3-[(7-chloranyl-2-ethyl-quinazolin-4-yl)-cyclohexyl-amino]-N-propan-2-yl-propanamide Openeye Name: 3-[(7-chloro-2-ethyl-quinazolin-4-yl)-cyclohexyl-amino]-N-isopropyl-propanamide CAS Name: 3-[(7-chloro-2-ethyl-4-quinazolinyl)-cyclohexylamino]-N-propan-2-ylpropanamide IUPAC Name: 3-[(7-chloro-2-ethylquinazolin-4-yl)-cyclohexylamino]-N-propan-2-ylpropanamide Traditional Name: 3-[(7-chloro-2-ethyl-quinazolin-4-yl)-cyclohexyl-amino]-N-isopropyl-propionamide Formula: C22H31ClN4O MolecularWeight: 402.96074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=CC(=C2)Cl)C(=N1)N(CCC(=O)NC(C)C)C3CCCCC3

Isomeric SMILES

CCC1=NC2=C(C=CC(=C2)Cl)C(=N1)N(CCC(=O)NC(C)C)C3CCCCC3

InChI

InChI=1S/C22H31ClN4O/c1-4-20-25-19-14-16(23)10-11-18(19)22(26-20)27(17-8-6-5-7-9-17)13-12-21(28)24-15(2)3/h10-11,14-15,17H,4-9,12-13H2,1-3H3,(H,24,28)