6-[[2-[(3-methoxyphenyl)amino]pyrimidin-4-yl]amino]-2,3-dihydro-1,4-benzodioxine-5-sulfonamide

Systemtic Name: 6-[[2-[(3-methoxyphenyl)amino]pyrimidin-4-yl]amino]-2,3-dihydro-1,4-benzodioxine-5-sulfonamide Openeye Name: 6-[[2-(3-methoxyanilino)pyrimidin-4-yl]amino]-2,3-dihydro-1,4-benzodioxine-5-sulfonamide CAS Name: 6-[[2-(3-methoxyanilino)-4-pyrimidinyl]amino]-2,3-dihydro-1,4-benzodioxin-5-sulfonamide IUPAC Name: 6-[[2-(3-methoxyanilino)pyrimidin-4-yl]amino]-2,3-dihydro-1,4-benzodioxine-5-sulfonamide Traditional Name: 6-[[2-(m-anisidino)pyrimidin-4-yl]amino]-2,3-dihydro-1,4-benzodioxin-5-sulfonamide Formula: C19H19N5O5S MolecularWeight: 429.44966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC=CC(=N2)NC3=C(C4=C(C=C3)OCCO4)S(=O)(=O)N

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC=CC(=N2)NC3=C(C4=C(C=C3)OCCO4)S(=O)(=O)N

InChI

InChI=1S/C19H19N5O5S/c1-27-13-4-2-3-12(11-13)22-19-21-8-7-16(24-19)23-14-5-6-15-17(29-10-9-28-15)18(14)30(20,25)26/h2-8,11H,9-10H2,1H3,(H2,20,25,26)(H2,21,22,23,24)