4-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]-N-[(1R)-1-phenylethyl]cyclohexan-1-amine

Systemtic Name: 4-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]-N-[(1R)-1-phenylethyl]cyclohexan-1-amine Openeye Name: 4-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]-N-[(1R)-1-phenylethyl]cyclohexanamine CAS Name: 4-[3-(4-chlorophenyl)-4-(4-pyrimidinyl)-1H-pyrazol-5-yl]-N-[(1R)-1-phenylethyl]-1-cyclohexanamine IUPAC Name: 4-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]-N-[(1R)-1-phenylethyl]cyclohexan-1-amine Traditional Name: [4-[3-(4-chlorophenyl)-4-(4-pyrimidyl)-1H-pyrazol-5-yl]cyclohexyl]-[(1R)-1-phenylethyl]amine Formula: C27H28ClN5 MolecularWeight: 457.99772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2CCC(CC2)C3=C(C(=NN3)C4=CC=C(C=C4)Cl)C5=NC=NC=C5

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC2CCC(CC2)C3=C(C(=NN3)C4=CC=C(C=C4)Cl)C5=NC=NC=C5

InChI

InChI=1S/C27H28ClN5/c1-18(19-5-3-2-4-6-19)31-23-13-9-21(10-14-23)27-25(24-15-16-29-17-30-24)26(32-33-27)20-7-11-22(28)12-8-20/h2-8,11-12,15-18,21,23,31H,9-10,13-14H2,1H3,(H,32,33)/t18-,21?,23?/m1/s1