(phenylmethyl) 4-[2-(2-chlorophenyl)-6-(1H-indazol-3-ylamino)-5-methyl-pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[2-(2-chlorophenyl)-6-(1H-indazol-3-ylamino)-5-methyl-pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: benzyl 4-[2-(2-chlorophenyl)-6-(1H-indazol-3-ylamino)-5-methyl-pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[2-(2-chlorophenyl)-6-(1H-indazol-3-ylamino)-5-methyl-4-pyrimidinyl]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-(2-chlorophenyl)-6-(1H-indazol-3-ylamino)-5-methylpyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[2-(2-chlorophenyl)-6-(1H-indazol-3-ylamino)-5-methyl-pyrimidin-4-yl]piperazine-1-carboxylic acid benzyl ester Formula: C30H28ClN7O2 MolecularWeight: 554.04202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1NC2=NNC3=CC=CC=C32)C4=CC=CC=C4Cl)N5CCN(CC5)C(=O)OCC6=CC=CC=C6

Isomeric SMILES

CC1=C(N=C(N=C1NC2=NNC3=CC=CC=C32)C4=CC=CC=C4Cl)N5CCN(CC5)C(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C30H28ClN7O2/c1-20-26(33-28-23-12-6-8-14-25(23)35-36-28)32-27(22-11-5-7-13-24(22)31)34-29(20)37-15-17-38(18-16-37)30(39)40-19-21-9-3-2-4-10-21/h2-14H,15-19H2,1H3,(H2,32,33,34,35,36)