Vitas-M small molecule compound
N-[3-(4-methoxyphenyl)-4-oxo-4H-[1]benzothieno[3,2-b]pyran-2-yl]-3-nitrobenzamide
Catalog ID
STK990983
SMILES COc1ccc(cc1)c1c(NC(=O)c2cccc(c2)[N+](=O)[O-])oc2c(c1=O)sc1c2cccc1
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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 C25H16N2O6S MW 472.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H16N2O6S/c1-32-17-11-9-14(10-12-17)20-21(28)23-22(18-7-2-3-8-19(18)34-23)33-25(20)26-24(29)15-5-4-6-16(13-15)27(30)31/h2-13H,1H3,(H,26,29)InChIKey
QRSXGBCLSMDHCS-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)C2=C(OC3=C(C2=O)SC4=CC=CC=C43)NC(=O)C5=CC(=CC=C5)(N+)(=O)(O)
COc1ccc(cc1)c1c(NC(=O)c2cccc(c2)(N+)(=O)(O))oc2c(c1=O)sc1c2cccc1
InChI=1SC25H16N2O6Sc1321711914(101217)2021(28)2322(18723819(18)3423)3325(20)2624(29)1554616(1315)27(30)31h213H1H3(H2629)
MFCD07801763
N(3(4methoxyphenyl)4oxo(1)benzothiolo(32b)pyran2yl)3nitrobenzamide
N(3(4methoxyphenyl)4oxo4H(1)benzothieno(32b)pyran2yl)3nitrobenzamide
ZINC000102971660
ZINC102971660
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