1-(4-bromanyl-6-methoxy-pyrimidin-2-yl)-3-[(2-methyl-3H-1,2-benzothiazol-7-yl)sulfonyl]urea

Systemtic Name: 1-(4-bromanyl-6-methoxy-pyrimidin-2-yl)-3-[(2-methyl-3H-1,2-benzothiazol-7-yl)sulfonyl]urea Openeye Name: 1-(4-bromo-6-methoxy-pyrimidin-2-yl)-3-[(2-methyl-3H-1,2-benzothiazol-7-yl)sulfonyl]urea CAS Name: 1-(4-bromo-6-methoxy-2-pyrimidinyl)-3-[(2-methyl-3H-1,2-benzothiazol-7-yl)sulfonyl]urea IUPAC Name: 1-(4-bromo-6-methoxypyrimidin-2-yl)-3-[(2-methyl-3H-1,2-benzothiazol-7-yl)sulfonyl]urea Traditional Name: 1-(4-bromo-6-methoxy-pyrimidin-2-yl)-3-[(2-methyl-3H-1,2-benzothiazol-7-yl)sulfonyl]urea Formula: C14H14BrN5O4S2 MolecularWeight: 460.32606

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(S1)C(=CC=C2)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)Br)OC

Isomeric SMILES

CN1CC2=C(S1)C(=CC=C2)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)Br)OC

InChI

InChI=1S/C14H14BrN5O4S2/c1-20-7-8-4-3-5-9(12(8)25-20)26(22,23)19-14(21)18-13-16-10(15)6-11(17-13)24-2/h3-6H,7H2,1-2H3,(H2,16,17,18,19,21)