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ethyl 4-oxidanylidene-6,7,8,9-tetrahydro-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-carboxylate

ethyl 4-oxidanylidene-6,7,8,9-tetrahydro-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-carboxylate

Systemtic Name:ethyl 4-oxidanylidene-6,7,8,9-tetrahydro-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-carboxylate
Openeye Name:ethyl 4-oxo-6,7,8,9-tetrahydro-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-carboxylate
CAS Name:4-oxo-6,7,8,9-tetrahydro-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-carboxylic acid ethyl ester
IUPAC Name:ethyl 4-oxo-6,7,8,9-tetrahydro-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-carboxylate
Traditional Name:4-keto-6,7,8,9-tetrahydro-1H-pyrimido[2,1-b][1,3]benzothiazol-5-ium-3-carboxylic acid ethyl ester
Formula: C13H15N2O3S+
MolecularWeight: 279.3348
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=[N+](C1=O)C3=C(S2)CCCC3


Isomeric SMILES

CCOC(=O)C1=CNC2=[N+](C1=O)C3=C(S2)CCCC3


InChI

InChI=1S/C13H14N2O3S/c1-2-18-12(17)8-7-14-13-15(11(8)16)9-5-3-4-6-10(9)19-13/h7H,2-6H2,1H3/p+1


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