[5-(2-methylpyridin-4-yl)pyrimidin-2-yl] 4-(5-chloranyl-3-oxidanyl-1H-indol-2-yl)piperazine-1-carboxylate

Systemtic Name: [5-(2-methylpyridin-4-yl)pyrimidin-2-yl] 4-(5-chloranyl-3-oxidanyl-1H-indol-2-yl)piperazine-1-carboxylate Openeye Name: [5-(2-methyl-4-pyridyl)pyrimidin-2-yl] 4-(5-chloro-3-hydroxy-1H-indol-2-yl)piperazine-1-carboxylate CAS Name: 4-(5-chloro-3-hydroxy-1H-indol-2-yl)-1-piperazinecarboxylic acid [5-(2-methyl-4-pyridinyl)-2-pyrimidinyl] ester IUPAC Name: [5-(2-methylpyridin-4-yl)pyrimidin-2-yl] 4-(5-chloro-3-hydroxy-1H-indol-2-yl)piperazine-1-carboxylate Traditional Name: 4-(5-chloro-3-hydroxy-1H-indol-2-yl)piperazine-1-carboxylic acid [5-(2-methyl-4-pyridyl)pyrimidin-2-yl] ester Formula: C23H21ClN6O3 MolecularWeight: 464.90424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)C2=CN=C(N=C2)OC(=O)N3CCN(CC3)C4=C(C5=C(N4)C=CC(=C5)Cl)O

Isomeric SMILES

CC1=NC=CC(=C1)C2=CN=C(N=C2)OC(=O)N3CCN(CC3)C4=C(C5=C(N4)C=CC(=C5)Cl)O

InChI

InChI=1S/C23H21ClN6O3/c1-14-10-15(4-5-25-14)16-12-26-22(27-13-16)33-23(32)30-8-6-29(7-9-30)21-20(31)18-11-17(24)2-3-19(18)28-21/h2-5,10-13,28,31H,6-9H2,1H3