1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(2-methoxy-5-methyl-phenyl)thiourea

Systemtic Name: 1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(2-methoxy-5-methyl-phenyl)thiourea Openeye Name: 1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(2-methoxy-5-methyl-phenyl)thiourea CAS Name: 1-[4-[[4-(dimethylamino)-2-quinazolinyl]amino]cyclohexyl]-3-(2-methoxy-5-methylphenyl)thiourea IUPAC Name: 1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(2-methoxy-5-methylphenyl)thiourea Traditional Name: 1-[4-[[4-(dimethylamino)quinazolin-2-yl]amino]cyclohexyl]-3-(2-methoxy-5-methyl-phenyl)thiourea Formula: C25H32N6OS MolecularWeight: 464.62618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)NC2CCC(CC2)NC3=NC4=CC=CC=C4C(=N3)N(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)NC2CCC(CC2)NC3=NC4=CC=CC=C4C(=N3)N(C)C

InChI

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