3-[[4-[(2-methyl-5-oxidanyl-phenyl)amino]pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 3-[[4-[(2-methyl-5-oxidanyl-phenyl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 3-[[4-(5-hydroxy-2-methyl-anilino)pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 3-[[4-(5-hydroxy-2-methylanilino)-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 3-[[4-(5-hydroxy-2-methylanilino)pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 3-[[4-(5-hydroxy-2-methyl-anilino)pyrimidin-2-yl]amino]benzenesulfonamide Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)O)NC2=NC(=NC=C2)NC3=CC(=CC=C3)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)O)NC2=NC(=NC=C2)NC3=CC(=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C17H17N5O3S/c1-11-5-6-13(23)10-15(11)21-16-7-8-19-17(22-16)20-12-3-2-4-14(9-12)26(18,24)25/h2-10,23H,1H3,(H2,18,24,25)(H2,19,20,21,22)