1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(4-methylsulfanylphenyl)thiourea

Systemtic Name: 1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(4-methylsulfanylphenyl)thiourea Openeye Name: 1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(4-methylsulfanylphenyl)thiourea CAS Name: 1-[4-[[4-(dimethylamino)-2-quinazolinyl]amino]cyclohexyl]-3-[4-(methylthio)phenyl]thiourea IUPAC Name: 1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(4-methylsulfanylphenyl)thiourea Traditional Name: 1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-[4-(methylthio)phenyl]thiourea Formula: C24H30N6S2 MolecularWeight: 466.6652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC2=CC=CC=C21)NC3CCC(CC3)NC(=S)NC4=CC=C(C=C4)SC

Isomeric SMILES

CN(C)C1=NC(=NC2=CC=CC=C21)NC3CCC(CC3)NC(=S)NC4=CC=C(C=C4)SC

InChI

InChI=1S/C24H30N6S2/c1-30(2)22-20-6-4-5-7-21(20)28-23(29-22)25-16-8-10-17(11-9-16)26-24(31)27-18-12-14-19(32-3)15-13-18/h4-7,12-17H,8-11H2,1-3H3,(H,25,28,29)(H2,26,27,31)