3-[3-(1-bromanyl-2-oxidanyl-propyl)-1,2-benzothiazol-5-yl]-1,6-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 3-[3-(1-bromanyl-2-oxidanyl-propyl)-1,2-benzothiazol-5-yl]-1,6-dimethyl-pyrimidine-2,4-dione Openeye Name: 3-[3-(1-bromo-2-hydroxy-propyl)-1,2-benzothiazol-5-yl]-1,6-dimethyl-pyrimidine-2,4-dione CAS Name: 3-[3-(1-bromo-2-hydroxypropyl)-1,2-benzothiazol-5-yl]-1,6-dimethylpyrimidine-2,4-dione IUPAC Name: 3-[3-(1-bromo-2-hydroxypropyl)-1,2-benzothiazol-5-yl]-1,6-dimethylpyrimidine-2,4-dione Traditional Name: 3-[3-(1-bromo-2-hydroxy-propyl)-1,2-benzothiazol-5-yl]-1,6-dimethyl-pyrimidine-2,4-quinone Formula: C16H16BrN3O3S MolecularWeight: 410.28554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=O)N1C)C2=CC3=C(C=C2)SN=C3C(C(C)O)Br

Isomeric SMILES

CC1=CC(=O)N(C(=O)N1C)C2=CC3=C(C=C2)SN=C3C(C(C)O)Br

InChI

InChI=1S/C16H16BrN3O3S/c1-8-6-13(22)20(16(23)19(8)3)10-4-5-12-11(7-10)15(18-24-12)14(17)9(2)21/h4-7,9,14,21H,1-3H3