Vitas-M small molecule compound
{[7,7-dimethyl-2-(3-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}acetic acid
Catalog ID
STK580393
SMILES OC(=O)CSc1nc(nc2c1COC(C2)(C)C)c1cccc(c1)C
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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 C18H20N2O3S MW 344.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O3S/c1-11-5-4-6-12(7-11)16-19-14-8-18(2,3)23-9-13(14)17(20-16)24-10-15(21)22/h4-7H,8-10H2,1-3H3,(H,21,22)InChIKey
CZJAHMCQDLRPHB-UHFFFAOYSA-NSynonyms
900896-93-7((77dimethyl2(3methylphenyl)78dihydro5Hpyrano(43d)pyrimidin4yl)sulfanyl)aceticacid
2((77DIMETHYL2(3METHYLPHENYL)58DIHYDROPYRANO(43D)PYRIMIDIN4YL)SULFANYL)ACETICACID
2((77dimethyl2(mtolyl)78dihydro5Hpyrano(43d)pyrimidin4yl)thio)aceticacid
900896937
CC1=CC=CC(=C1)C2=NC3=C(COC(C3)(C)C)C(=N2)SCC(=O)O
InChI=1SC18H20N2O3Sc11154612(711)161914818(23)23913(14)17(2016)241015(21)22h47H810H213H3(H2122)
MFCD06777130
ZINC000005269509
ZINC5269509
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