methyl (2R)-4-[(3-chloranyl-1H-indol-6-yl)sulfonyl]-1-[[1-(1-methyl-6-oxidanylidene-pyridazin-3-yl)piperidin-4-yl]methyl]-6-oxidanylidene-piperazine-2-carboxylate

Systemtic Name: methyl (2R)-4-[(3-chloranyl-1H-indol-6-yl)sulfonyl]-1-[[1-(1-methyl-6-oxidanylidene-pyridazin-3-yl)piperidin-4-yl]methyl]-6-oxidanylidene-piperazine-2-carboxylate Openeye Name: methyl (2R)-4-[(3-chloro-1H-indol-6-yl)sulfonyl]-1-[[1-(1-methyl-6-oxo-pyridazin-3-yl)-4-piperidyl]methyl]-6-oxo-piperazine-2-carboxylate CAS Name: (2R)-4-[(3-chloro-1H-indol-6-yl)sulfonyl]-1-[[1-(1-methyl-6-oxo-3-pyridazinyl)-4-piperidinyl]methyl]-6-oxo-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[(3-chloro-1H-indol-6-yl)sulfonyl]-1-[[1-(1-methyl-6-oxopyridazin-3-yl)piperidin-4-yl]methyl]-6-oxopiperazine-2-carboxylate Traditional Name: (2R)-4-[(3-chloro-1H-indol-6-yl)sulfonyl]-6-keto-1-[[1-(6-keto-1-methyl-pyridazin-3-yl)-4-piperidyl]methyl]piperazine-2-carboxylic acid methyl ester Formula: C25H29ClN6O6S MolecularWeight: 577.05236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=CC(=N1)N2CCC(CC2)CN3C(CN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C(=CN5)Cl)C(=O)OC

Isomeric SMILES

CN1C(=O)C=CC(=N1)N2CCC(CC2)CN3[C@H](CN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C(=CN5)Cl)C(=O)OC

InChI

InChI=1S/C25H29ClN6O6S/c1-29-23(33)6-5-22(28-29)30-9-7-16(8-10-30)13-32-21(25(35)38-2)14-31(15-24(32)34)39(36,37)17-3-4-18-19(26)12-27-20(18)11-17/h3-6,11-12,16,21,27H,7-10,13-15H2,1-2H3/t21-/m1/s1