3-[[5-azanyl-2-[(3-methoxyphenyl)-methyl-amino]pyrimidin-4-yl]amino]benzenesulfonamide

Systemtic Name: 3-[[5-azanyl-2-[(3-methoxyphenyl)-methyl-amino]pyrimidin-4-yl]amino]benzenesulfonamide Openeye Name: 3-[[5-amino-2-(3-methoxy-N-methyl-anilino)pyrimidin-4-yl]amino]benzenesulfonamide CAS Name: 3-[[5-amino-2-(3-methoxy-N-methylanilino)-4-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 3-[[5-amino-2-(3-methoxy-N-methylanilino)pyrimidin-4-yl]amino]benzenesulfonamide Traditional Name: 3-[[5-amino-2-(3-methoxy-N-methyl-anilino)pyrimidin-4-yl]amino]benzenesulfonamide Formula: C18H20N6O3S MolecularWeight: 400.4548

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC(=CC=C1)OC)C2=NC=C(C(=N2)NC3=CC(=CC=C3)S(=O)(=O)N)N

Isomeric SMILES

CN(C1=CC(=CC=C1)OC)C2=NC=C(C(=N2)NC3=CC(=CC=C3)S(=O)(=O)N)N

InChI

InChI=1S/C18H20N6O3S/c1-24(13-6-4-7-14(10-13)27-2)18-21-11-16(19)17(23-18)22-12-5-3-8-15(9-12)28(20,25)26/h3-11H,19H2,1-2H3,(H2,20,25,26)(H,21,22,23)