Vitas-M small molecule compound
2-methoxy-6-[(E)-{[3-(methoxycarbonyl)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl]imino}methyl]phenolate
Catalog ID
STL039457
SMILES COC(=O)c1c(/N=C/c2cccc(c2[O-])OC)sc2c1CC[NH+](C2)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 C18H20N2O4S MW 360.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O4S/c1-20-8-7-12-14(10-20)25-17(15(12)18(22)24-3)19-9-11-5-4-6-13(23-2)16(11)21/h4-6,9,21H,7-8,10H2,1-3H3/b19-9+InChIKey
HWGHVWXWOQVQGH-DJKKODMXSA-NSynonyms
2methoxy6((E)((3(methoxycarbonyl)6methyl4567tetrahydrothieno(23c)pyridin6ium2yl)imino)methyl)phenolate
2methoxy6((E)(3methoxycarbonyl6methyl4567tetrahydrothieno(23c)pyridin6ium2yl)iminomethyl)phenolate
C(NH+)1CCC2=C(C1)SC(=C2C(=O)OC)N=CC3=C(C(=CC=C3)OC)(O)
COC(=O)c1c(N=Cc2cccc(c2(O))OC)sc2c1CC(NH+)(C2)C
InChI=1SC18H20N2O4Sc120871214(1020)2517(15(12)18(22)243)1991154613(232)16(11)21h46921H7810H213H3b199+
MFCD01147610
ZINC000033334664
Check stock
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