4-[[4-chloranyl-1-(4-ethylphenyl)-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[[4-chloranyl-1-(4-ethylphenyl)-2,5-bis(oxidanylidene)pyrrol-3-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[[4-chloro-1-(4-ethylphenyl)-2,5-dioxo-pyrrol-3-yl]amino]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[[4-chloro-1-(4-ethylphenyl)-2,5-dioxo-3-pyrrolyl]amino]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[[4-chloro-1-(4-ethylphenyl)-2,5-dioxopyrrol-3-yl]amino]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[[4-chloro-1-(4-ethylphenyl)-2,5-diketo-3-pyrrolin-3-yl]amino]-N-(2-pyrimidyl)benzenesulfonamide Formula: C22H18ClN5O4S MolecularWeight: 483.92742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)Cl)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

InChI

InChI=1S/C22H18ClN5O4S/c1-2-14-4-8-16(9-5-14)28-20(29)18(23)19(21(28)30)26-15-6-10-17(11-7-15)33(31,32)27-22-24-12-3-13-25-22/h3-13,26H,2H2,1H3,(H,24,25,27)