4-[[4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2,5-bis(oxidanylidene)-1-phenethyl-pyrrol-3-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2,5-bis(oxidanylidene)-1-phenethyl-pyrrol-3-yl]amino]benzenesulfonamide Openeye Name: 4-[[4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2,5-dioxo-1-phenethyl-pyrrol-3-yl]amino]benzenesulfonamide CAS Name: 4-[[4-[(4,6-dimethyl-2-pyrimidinyl)thio]-2,5-dioxo-1-phenethyl-3-pyrrolyl]amino]benzenesulfonamide IUPAC Name: 4-[[4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2,5-dioxo-1-phenethylpyrrol-3-yl]amino]benzenesulfonamide Traditional Name: 4-[[4-[(4,6-dimethylpyrimidin-2-yl)thio]-2,5-diketo-1-phenethyl-3-pyrrolin-3-yl]amino]benzenesulfonamide Formula: C24H23N5O4S2 MolecularWeight: 509.60052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)NC4=CC=C(C=C4)S(=O)(=O)N)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)NC4=CC=C(C=C4)S(=O)(=O)N)C

InChI

InChI=1S/C24H23N5O4S2/c1-15-14-16(2)27-24(26-15)34-21-20(28-18-8-10-19(11-9-18)35(25,32)33)22(30)29(23(21)31)13-12-17-6-4-3-5-7-17/h3-11,14,28H,12-13H2,1-2H3,(H2,25,32,33)