4-(2-azanyl-3-cyano-4-phenyl-pyrrol-1-yl)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide

Systemtic Name: 4-(2-azanyl-3-cyano-4-phenyl-pyrrol-1-yl)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide Openeye Name: 4-(2-amino-3-cyano-4-phenyl-pyrrol-1-yl)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide CAS Name: 4-(2-amino-3-cyano-4-phenyl-1-pyrrolyl)-N-(4-methyl-2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-(2-amino-3-cyano-4-phenylpyrrol-1-yl)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide Traditional Name: 4-(2-amino-3-cyano-4-phenyl-pyrrol-1-yl)-N-(4-methylpyrimidin-2-yl)benzenesulfonamide Formula: C22H18N6O2S MolecularWeight: 430.48232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N3C=C(C(=C3N)C#N)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=NC=C1)NS(=O)(=O)C2=CC=C(C=C2)N3C=C(C(=C3N)C#N)C4=CC=CC=C4

InChI

InChI=1S/C22H18N6O2S/c1-15-11-12-25-22(26-15)27-31(29,30)18-9-7-17(8-10-18)28-14-20(19(13-23)21(28)24)16-5-3-2-4-6-16/h2-12,14H,24H2,1H3,(H,25,26,27)