[5-chloranyl-2-[2-[2-(oxidanylidenemethylidene)-1H-pyrimidin-5-yl]-3-piperazin-1-yl-pyridin-4-yl]sulfonyl-1H-indol-3-yl] ethanoate

Systemtic Name: [5-chloranyl-2-[2-[2-(oxidanylidenemethylidene)-1H-pyrimidin-5-yl]-3-piperazin-1-yl-pyridin-4-yl]sulfonyl-1H-indol-3-yl] ethanoate Openeye Name: [5-chloro-2-[[2-[2-(oxomethylene)-1H-pyrimidin-5-yl]-3-piperazin-1-yl-4-pyridyl]sulfonyl]-1H-indol-3-yl] acetate CAS Name: acetic acid [5-chloro-2-[[2-[2-(oxomethylidene)-1H-pyrimidin-5-yl]-3-(1-piperazinyl)-4-pyridinyl]sulfonyl]-1H-indol-3-yl] ester IUPAC Name: [5-chloro-2-[2-[2-(oxomethylidene)-1H-pyrimidin-5-yl]-3-piperazin-1-ylpyridin-4-yl]sulfonyl-1H-indol-3-yl] acetate Traditional Name: acetic acid [5-chloro-2-[[2-[2-(ketomethylene)-1H-pyrimidin-5-yl]-3-piperazino-4-pyridyl]sulfonyl]-1H-indol-3-yl] ester Formula: C24H21ClN6O5S MolecularWeight: 540.97874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(NC2=C1C=C(C=C2)Cl)S(=O)(=O)C3=C(C(=NC=C3)C4=CNC(=C=O)N=C4)N5CCNCC5

Isomeric SMILES

CC(=O)OC1=C(NC2=C1C=C(C=C2)Cl)S(=O)(=O)C3=C(C(=NC=C3)C4=CNC(=C=O)N=C4)N5CCNCC5

InChI

InChI=1S/C24H21ClN6O5S/c1-14(33)36-23-17-10-16(25)2-3-18(17)30-24(23)37(34,35)19-4-5-27-21(15-11-28-20(13-32)29-12-15)22(19)31-8-6-26-7-9-31/h2-5,10-12,26,28,30H,6-9H2,1H3