N-[[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]methyl]-2-ethylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]methyl]-2-ethylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]methyl]-2-ethylsulfanyl-pyridine-3-carboxamide CAS Name: N-[[4-[[4-(dimethylamino)-2-quinazolinyl]amino]cyclohexyl]methyl]-2-(ethylthio)-3-pyridinecarboxamide IUPAC Name: N-[[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]methyl]-2-ethylsulfanylpyridine-3-carboxamide Traditional Name: N-[[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]methyl]-2-(ethylthio)nicotinamide Formula: C25H32N6OS MolecularWeight: 464.62618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=CC=N1)C(=O)NCC2CCC(CC2)NC3=NC4=CC=CC=C4C(=N3)N(C)C

Isomeric SMILES

CCSC1=C(C=CC=N1)C(=O)NCC2CCC(CC2)NC3=NC4=CC=CC=C4C(=N3)N(C)C

InChI

InChI=1S/C25H32N6OS/c1-4-33-24-20(9-7-15-26-24)23(32)27-16-17-11-13-18(14-12-17)28-25-29-21-10-6-5-8-19(21)22(30-25)31(2)3/h5-10,15,17-18H,4,11-14,16H2,1-3H3,(H,27,32)(H,28,29,30)