N2-(3-chloranyl-4-methoxy-phenyl)-N4-cycloheptyl-6-phenyl-pyrimidine-2,4-diamine

Systemtic Name: N2-(3-chloranyl-4-methoxy-phenyl)-N4-cycloheptyl-6-phenyl-pyrimidine-2,4-diamine Openeye Name: N2-(3-chloro-4-methoxy-phenyl)-N4-cycloheptyl-6-phenyl-pyrimidine-2,4-diamine CAS Name: N2-(3-chloro-4-methoxyphenyl)-N4-cycloheptyl-6-phenylpyrimidine-2,4-diamine IUPAC Name: 2-N-(3-chloro-4-methoxyphenyl)-4-N-cycloheptyl-6-phenylpyrimidine-2,4-diamine Traditional Name: [2-(3-chloro-4-methoxy-anilino)-6-phenyl-pyrimidin-4-yl]-cycloheptyl-amine Formula: C24H27ClN4O MolecularWeight: 422.95038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=CC(=N2)NC3CCCCCC3)C4=CC=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=CC(=N2)NC3CCCCCC3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C24H27ClN4O/c1-30-22-14-13-19(15-20(22)25)27-24-28-21(17-9-5-4-6-10-17)16-23(29-24)26-18-11-7-2-3-8-12-18/h4-6,9-10,13-16,18H,2-3,7-8,11-12H2,1H3,(H2,26,27,28,29)