[5-chloranyl-2-[4-[5-(2-methylpyridin-4-yl)pyrimidin-2-yl]carbonylpiperazin-1-yl]sulfonyl-1H-indol-3-yl] ethanoate

Systemtic Name: [5-chloranyl-2-[4-[5-(2-methylpyridin-4-yl)pyrimidin-2-yl]carbonylpiperazin-1-yl]sulfonyl-1H-indol-3-yl] ethanoate Openeye Name: [5-chloro-2-[4-[5-(2-methyl-4-pyridyl)pyrimidine-2-carbonyl]piperazin-1-yl]sulfonyl-1H-indol-3-yl] acetate CAS Name: acetic acid [5-chloro-2-[[4-[[5-(2-methyl-4-pyridinyl)-2-pyrimidinyl]-oxomethyl]-1-piperazinyl]sulfonyl]-1H-indol-3-yl] ester IUPAC Name: [5-chloro-2-[4-[5-(2-methylpyridin-4-yl)pyrimidine-2-carbonyl]piperazin-1-yl]sulfonyl-1H-indol-3-yl] acetate Traditional Name: acetic acid [5-chloro-2-[4-[5-(2-methyl-4-pyridyl)pyrimidine-2-carbonyl]piperazino]sulfonyl-1H-indol-3-yl] ester Formula: C25H23ClN6O5S MolecularWeight: 555.00532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23ClN6O5S/c1-15-11-17(5-6-27-15)18-13-28-23(29-14-18)25(34)31-7-9-32(10-8-31)38(35,36)24-22(37-16(2)33)20-12-19(26)3-4-21(20)30-24/h3-6,11-14,30H,7-10H2,1-2H3