Vitas-M small molecule compound
5-chloro-3-ethyl-2-{(E)-2-[methyl(phenyl)amino]ethenyl}-1,3-benzoxazol-3-ium
Catalog ID
STK396595
SMILES CC[n+]1c(/C=C/N(c2ccccc2)C)oc2c1cc(Cl)cc2
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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 C18H18ClN2O MW 313.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN2O/c1-3-21-16-13-14(19)9-10-17(16)22-18(21)11-12-20(2)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3/q+1InChIKey
MNDNSIUYIXBUEM-UHFFFAOYSA-NSynonyms
((E)2(5CHLORO3ETHYL13BENZOXAZOL3IUM2YL)VINYL)METHYLPHENYLAMINE2HYDROXYETHANESULFONATE
(E)5chloro3ethyl2(2(methyl(phenyl)amino)vinyl)benzo(d)oxazol3iumbromide
5chloro3ethyl2((E)2(methyl(phenyl)amino)ethenyl)13benzoxazol3ium
5CHLORO3ETHYL2(2(METHYL(PHENYL)AMINO)VINYL)13BENZOXAZOL3IUMETHYLSULFATE
CC(N+)1=C(OC2=C1C=C(C=C2)Cl)C=CN(C)C3=CC=CC=C3
CC(n+)1c(C=CN(c2ccccc2)C)oc2c1cc(Cl)cc2
CC(n+)1c(C=CN(c2ccccc2)C)oc2c1cc(Cl)cc2(Br)
InChI=1SC18H18ClN2Oc1321161314(19)91017(16)2218(21)111220(2)157546815h413H3H212H3q+1
MFCD02983758
N((E)2(5CHLORANYL3ETHYL13BENZOXAZOL3IUM2YL)ETHENYL)NMETHYLANILINE2OXIDANYLETHANESULFONATE
N((E)2(5CHLORO3ETHYL13BENZOXAZOL3IUM2YL)ETHENYL)NMETHYLANILINE
N((E)2(5CHLORO3ETHYL13BENZOXAZOL3IUM2YL)ETHENYL)NMETHYLANILINE2HYDROXYETHANESULFONATE
N(2(5CHLORO3ETHYL13BENZOXAZOL3IUM2YL)ETHENYL)NMETHYLANILINE
ZINC00294906
ZINC294906
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