Vitas-M small molecule compound
2-methoxy-4-(pyrrolidin-1-ylcarbonothioyl)phenyl 3-chlorobenzoate
Catalog ID
STK047007
SMILES COc1cc(ccc1OC(=O)c1cccc(c1)Cl)C(=S)N1CCCC1
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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 C19H18ClNO3S MW 375.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClNO3S/c1-23-17-12-13(18(25)21-9-2-3-10-21)7-8-16(17)24-19(22)14-5-4-6-15(20)11-14/h4-8,11-12H,2-3,9-10H2,1H3InChIKey
ADZBUKIAHWYWQA-UHFFFAOYSA-NSynonyms
(2METHOXY4(PYRROLIDINE1CARBOTHIOYL)PHENYL)3CHLOROBENZOATE
2METHOXY4(PYRROLIDIN1YLCARBONOTHIOYL)PHENYL3CHLOROBENZOATE
COC1=C(C=CC(=C1)C(=S)N2CCCC2)OC(=O)C3=CC(=CC=C3)Cl
COc1cc(ccc1OC(=O)c1cccc(c1)Cl)C(=S)N1CCCC1
InChI=1SC19H18ClNO3Sc123171213(18(25)219231021)7816(17)2419(22)1454615(20)1114h481112H23910H21H3
MFCD02895387
STK047007
ZINC000005743915
ZINC05743915
ZINC5743915
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