N6-[2-azanyl-6-(2-chlorophenyl)pyrimidin-4-yl]-2-(4-cyclohexylphenyl)quinoline-4,6-diamine

Systemtic Name: N6-[2-azanyl-6-(2-chlorophenyl)pyrimidin-4-yl]-2-(4-cyclohexylphenyl)quinoline-4,6-diamine Openeye Name: N6-[2-amino-6-(2-chlorophenyl)pyrimidin-4-yl]-2-(4-cyclohexylphenyl)quinoline-4,6-diamine CAS Name: N6-[2-amino-6-(2-chlorophenyl)-4-pyrimidinyl]-2-(4-cyclohexylphenyl)quinoline-4,6-diamine IUPAC Name: 6-N-[2-amino-6-(2-chlorophenyl)pyrimidin-4-yl]-2-(4-cyclohexylphenyl)quinoline-4,6-diamine Traditional Name: [2-amino-6-(2-chlorophenyl)pyrimidin-4-yl]-[4-amino-2-(4-cyclohexylphenyl)-6-quinolyl]amine Formula: C31H29ClN6 MolecularWeight: 521.05516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C3=NC4=C(C=C(C=C4)NC5=NC(=NC(=C5)C6=CC=CC=C6Cl)N)C(=C3)N

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C3=NC4=C(C=C(C=C4)NC5=NC(=NC(=C5)C6=CC=CC=C6Cl)N)C(=C3)N

InChI

InChI=1S/C31H29ClN6/c32-25-9-5-4-8-23(25)29-18-30(38-31(34)37-29)35-22-14-15-27-24(16-22)26(33)17-28(36-27)21-12-10-20(11-13-21)19-6-2-1-3-7-19/h4-5,8-19H,1-3,6-7H2,(H2,33,36)(H3,34,35,37,38)