Vitas-M small molecule compound
1-ethyl-2-[(E)-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)methyl]-6-methylquinolinium
Catalog ID
STK376573
SMILES COc1ccc2c(c1)n(C)/c(=C\c1ccc3c([n+]1CC)ccc(c3)C)/s2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H23N2OS MW 363.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N2OS/c1-5-24-17(8-7-16-12-15(2)6-10-19(16)24)13-22-23(3)20-14-18(25-4)9-11-21(20)26-22/h6-14H,5H2,1-4H3/q+1InChIKey
OGZUKRYKRILJKD-UHFFFAOYSA-NSynonyms
(2E)2((1ETHYL6METHYLQUINOLIN1IUM2YL)METHYLIDENE)5METHOXY3METHYL13BENZOTHIAZOLE
(2Z)2((1ETHYL6METHYLQUINOLIN1IUM2YL)METHYLIDENE)5METHOXY3METHYL13BENZOTHIAZOLE
1ethyl2((E)(5methoxy3methyl13benzothiazol2(3H)ylidene)methyl)6methylquinolinium
2((1ETHYL6METHYL(2QUINOLYL))METHYLENE)5METHOXY3METHYL3HYDROBENZOTHIAZOLE
2((1ETHYL6METHYLQUINOLIN1IUM2YL)METHYLIDENE)5METHOXY3METHYL13BENZOTHIAZOLE
CC(N+)1=C(C=CC2=C1C=CC(=C2)C)C=C3N(C4=C(S3)C=CC(=C4)OC)C
COc1ccc2c(c1)n(C)c(=Cc1ccc3c((n+)1CC)ccc(c3)C)s2
InChI=1SC22H23N2OSc152417(87161215(2)61019(16)24)132223(3)201418(254)91121(20)2622h614H5H214H3q+1
ZINC000004045861
ZINC04045861
ZINC13602730
ZINC4045861
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