Vitas-M small molecule compound
4-bromo-2-(pyrrolidin-1-ylcarbonothioyl)phenyl naphthalene-2-carboxylate
Catalog ID
STK063835
SMILES Brc1ccc(c(c1)C(=S)N1CCCC1)OC(=O)c1ccc2c(c1)cccc2
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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 C22H18BrNO2S MW 440.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrNO2S/c23-18-9-10-20(19(14-18)21(27)24-11-3-4-12-24)26-22(25)17-8-7-15-5-1-2-6-16(15)13-17/h1-2,5-10,13-14H,3-4,11-12H2InChIKey
QQQWGEIRGUIPEC-UHFFFAOYSA-NSynonyms
(4BROMO2(PYRROLIDINE1CARBOTHIOYL)PHENYL)NAPHTHALENE2CARBOXYLATE
4BROMO2(PYRROLIDIN1YLCARBONOTHIOYL)PHENYLNAPHTHALENE2CARBOXYLATE
Brc1ccc(c(c1)C(=S)N1CCCC1)OC(=O)c1ccc2c(c1)cccc2
C1CCN(C1)C(=S)C2=C(C=CC(=C2)Br)OC(=O)C3=CC4=CC=CC=C4C=C3
InChI=1SC22H18BrNO2Sc231891020(19(1418)21(27)2411341224)2622(25)178715512616(15)1317h125101314H341112H2
MFCD08051661
STK063835
ZINC000013897322
ZINC13897322
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