Vitas-M small molecule compound
(2E)-2-{3-methoxy-4-[2-oxo-2-(pyrrolidin-1-yl)ethoxy]benzylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STL380184
SMILES COc1cc(ccc1OCC(=O)N1CCCC1)/C=c\1/sc2n(c1=O)c1c(n2)cccc1
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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 C23H21N3O4S MW 435.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O4S/c1-29-19-12-15(8-9-18(19)30-14-21(27)25-10-4-5-11-25)13-20-22(28)26-17-7-3-2-6-16(17)24-23(26)31-20/h2-3,6-9,12-13H,4-5,10-11,14H2,1H3/b20-13+InChIKey
BSQQKBVVIOOTAJ-DEDYPNTBSA-NSynonyms
(2E)2((3METHOXY4(2OXO2PYRROLIDIN1YLETHOXY)PHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2E)2(3methoxy4(2oxo2(pyrrolidin1yl)ethoxy)benzylidene)(13)thiazolo(32a)benzimidazol3(2H)one
2(3METHOXY4(2OXO2(1PYRROLIDINYL)ETHOXY)BENZYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL3(2H)ONE
COC1=C(C=CC(=C1)C=C2C(=O)N3C4=CC=CC=C4N=C3S2)OCC(=O)N5CCCC5
COc1cc(ccc1OCC(=O)N1CCCC1)C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC23H21N3O4Sc129191215(8918(19)301421(27)2510451125)132022(28)2617732616(17)2423(26)3120h23691213H45101114H21H3b2013+
MFCD04091262
ZINC000008426022
ZINC08426022
ZINC8426022
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