2-[(3-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)oxymethyl]-6-methoxy-1,1-bis(oxidanylidene)-4-propan-2-yl-1,2-benzothiazol-3-one

Systemtic Name: 2-[(3-bromanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)oxymethyl]-6-methoxy-1,1-bis(oxidanylidene)-4-propan-2-yl-1,2-benzothiazol-3-one Openeye Name: 2-[(3-bromo-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)oxymethyl]-4-isopropyl-6-methoxy-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[(3-bromo-4-oxo-2-pyrido[1,2-a]pyrimidinyl)oxymethyl]-6-methoxy-1,1-dioxo-4-propan-2-yl-1,2-benzothiazol-3-one IUPAC Name: 2-[(3-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)oxymethyl]-6-methoxy-1,1-dioxo-4-propan-2-yl-1,2-benzothiazol-3-one Traditional Name: 2-[(3-bromo-4-keto-pyrido[1,2-a]pyrimidin-2-yl)oxymethyl]-4-isopropyl-1,1-diketo-6-methoxy-1,2-benzothiazol-3-one Formula: C20H18BrN3O6S MolecularWeight: 508.34242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC2=C1C(=O)N(S2(=O)=O)COC3=C(C(=O)N4C=CC=CC4=N3)Br)OC

Isomeric SMILES

CC(C)C1=CC(=CC2=C1C(=O)N(S2(=O)=O)COC3=C(C(=O)N4C=CC=CC4=N3)Br)OC

InChI

InChI=1S/C20H18BrN3O6S/c1-11(2)13-8-12(29-3)9-14-16(13)19(25)24(31(14,27)28)10-30-18-17(21)20(26)23-7-5-4-6-15(23)22-18/h4-9,11H,10H2,1-3H3