4-[[4-(4-cyclopropyl-2,6-dimethyl-phenoxy)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[4-(4-cyclopropyl-2,6-dimethyl-phenoxy)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 4-[[4-(4-cyclopropyl-2,6-dimethyl-phenoxy)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 4-[[4-(4-cyclopropyl-2,6-dimethylphenoxy)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]amino]benzenesulfonamide IUPAC Name: 4-[[4-(4-cyclopropyl-2,6-dimethylphenoxy)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 4-[[4-(4-cyclopropyl-2,6-dimethyl-phenoxy)-5H-pyrrolo[3,2-d]pyrimidin-2-yl]amino]benzenesulfonamide Formula: C23H23N5O3S MolecularWeight: 449.52542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=NC(=NC3=C2NC=C3)NC4=CC=C(C=C4)S(=O)(=O)N)C)C5CC5

Isomeric SMILES

CC1=CC(=CC(=C1OC2=NC(=NC3=C2NC=C3)NC4=CC=C(C=C4)S(=O)(=O)N)C)C5CC5

InChI

InChI=1S/C23H23N5O3S/c1-13-11-16(15-3-4-15)12-14(2)21(13)31-22-20-19(9-10-25-20)27-23(28-22)26-17-5-7-18(8-6-17)32(24,29)30/h5-12,15,25H,3-4H2,1-2H3,(H2,24,29,30)(H,26,27,28)