8-methoxy-3-(2-methylpropyl)-4-oxidanyl-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one

Systemtic Name: 8-methoxy-3-(2-methylpropyl)-4-oxidanyl-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one Openeye Name: 4-hydroxy-3-isobutyl-8-methoxy-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one CAS Name: 4-hydroxy-8-methoxy-3-(2-methylpropyl)-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one IUPAC Name: 4-hydroxy-8-methoxy-3-(2-methylpropyl)-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one Traditional Name: 4-hydroxy-3-isobutyl-8-methoxy-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-2-one Formula: C15H17N2O3S+ MolecularWeight: 305.37208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C([N+]2=C(NC1=O)SC3=C2C=CC(=C3)OC)O

Isomeric SMILES

CC(C)CC1=C([N+]2=C(NC1=O)SC3=C2C=CC(=C3)OC)O

InChI

InChI=1S/C15H16N2O3S/c1-8(2)6-10-13(18)16-15-17(14(10)19)11-5-4-9(20-3)7-12(11)21-15/h4-5,7-8H,6H2,1-3H3,(H,18,19)/p+1