4-[4-azanyl-7-(4-methylphenyl)-2-oxidanylidene-3H-pyrrolo[2,3-d]pyrimidin-5-yl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 4-[4-azanyl-7-(4-methylphenyl)-2-oxidanylidene-3H-pyrrolo[2,3-d]pyrimidin-5-yl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 4-[4-amino-2-oxo-7-(p-tolyl)-3H-pyrrolo[2,3-d]pyrimidin-5-yl]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[4-amino-7-(4-methylphenyl)-2-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[4-amino-7-(4-methylphenyl)-2-oxo-3H-pyrrolo[2,3-d]pyrimidin-5-yl]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[4-amino-2-keto-7-(p-tolyl)-3H-pyrrolo[2,3-d]pyrimidin-5-yl]-N,N-dimethyl-benzenesulfonamide Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C3=C(NC(=O)N=C32)N)C4=CC=C(C=C4)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C3=C(NC(=O)N=C32)N)C4=CC=C(C=C4)S(=O)(=O)N(C)C

InChI

InChI=1S/C21H21N5O3S/c1-13-4-8-15(9-5-13)26-12-17(18-19(22)23-21(27)24-20(18)26)14-6-10-16(11-7-14)30(28,29)25(2)3/h4-12H,1-3H3,(H3,22,23,24,27)