1-(2-bromanyl-4-methyl-phenyl)-3-[4-[[4-(dimethylamino)quinolin-2-yl]amino]cyclohexyl]thiourea

Systemtic Name: 1-(2-bromanyl-4-methyl-phenyl)-3-[4-[[4-(dimethylamino)quinolin-2-yl]amino]cyclohexyl]thiourea Openeye Name: 1-(2-bromo-4-methyl-phenyl)-3-[4-[[4-(dimethylamino)-2-quinolyl]amino]cyclohexyl]thiourea CAS Name: 1-(2-bromo-4-methylphenyl)-3-[4-[[4-(dimethylamino)-2-quinolinyl]amino]cyclohexyl]thiourea IUPAC Name: 1-(2-bromo-4-methylphenyl)-3-[4-[[4-(dimethylamino)quinolin-2-yl]amino]cyclohexyl]thiourea Traditional Name: 1-(2-bromo-4-methyl-phenyl)-3-[4-[[4-(dimethylamino)-2-quinolyl]amino]cyclohexyl]thiourea Formula: C25H30BrN5S MolecularWeight: 512.5082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC2CCC(CC2)NC3=NC4=CC=CC=C4C(=C3)N(C)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC2CCC(CC2)NC3=NC4=CC=CC=C4C(=C3)N(C)C)Br

InChI

InChI=1S/C25H30BrN5S/c1-16-8-13-22(20(26)14-16)30-25(32)28-18-11-9-17(10-12-18)27-24-15-23(31(2)3)19-6-4-5-7-21(19)29-24/h4-8,13-15,17-18H,9-12H2,1-3H3,(H,27,29)(H2,28,30,32)