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7-[(4-tert-butylphenoxy)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one
7-[(4-tert-butylphenoxy)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one
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Descriptors Computed from Structure
Canonical SMILES:
CC(C)(C)C1=CC=C(C=C1)OCC2=CC(=O)[N+]3=C(N2)SC=C3
Isomeric SMILES
CC(C)(C)C1=CC=C(C=C1)OCC2=CC(=O)[N+]3=C(N2)SC=C3
InChI
InChI=1S/C17H18N2O2S/c1-17(2,3)12-4-6-14(7-5-12)21-11-13-10-15(20)19-8-9-22-16(19)18-13/h4-10H,11H2,1-3H3/p+1
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- (5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl 1,3-benzodioxole-5-carboxylate
- (5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl 3,4,5-trimethoxybenzoate
- (5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-yl)methyl 6-chloranylpyridine-3-carboxylate
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- 7-[(4-phenylpiperazin-1-ium-1-yl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one
- 7-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanylmethyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one
- 7-[(4-phenylpiperazin-1-yl)methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one
- (2R)-N-aminocarbonyl-2-[[4-(4-chlorophenyl)-5-indol-3-ylidene-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide
- 7-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one
- 7-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one
