3-[[4-[(6-azanyl-5-methoxy-pyridin-2-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 3-[[4-[(6-azanyl-5-methoxy-pyridin-2-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 3-[[4-[(6-amino-5-methoxy-2-pyridyl)amino]-5-fluoro-pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 3-[[4-[(6-amino-5-methoxy-2-pyridinyl)amino]-5-fluoro-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 3-[[4-[(6-amino-5-methoxypyridin-2-yl)amino]-5-fluoropyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 3-[[4-[(6-amino-5-methoxy-2-pyridyl)amino]-5-fluoro-pyrimidin-2-yl]amino]benzenesulfonamide Formula: C16H16FN7O3S MolecularWeight: 405.406743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=C(C=C1)NC2=NC(=NC=C2F)NC3=CC(=CC=C3)S(=O)(=O)N)N

Isomeric SMILES

COC1=C(N=C(C=C1)NC2=NC(=NC=C2F)NC3=CC(=CC=C3)S(=O)(=O)N)N

InChI

InChI=1S/C16H16FN7O3S/c1-27-12-5-6-13(22-14(12)18)23-15-11(17)8-20-16(24-15)21-9-3-2-4-10(7-9)28(19,25)26/h2-8H,1H3,(H2,19,25,26)(H4,18,20,21,22,23,24)