Vitas-M small molecule compound
N-[3-cyano-4-(2,5-dimethylphenyl)thiophen-2-yl]-6-nitro-2-oxo-2H-chromene-3-carboxamide
Catalog ID
STK464486
SMILES N#Cc1c(scc1c1cc(C)ccc1C)NC(=O)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]
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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 C23H15N3O5S MW 445.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15N3O5S/c1-12-3-4-13(2)16(7-12)19-11-32-22(18(19)10-24)25-21(27)17-9-14-8-15(26(29)30)5-6-20(14)31-23(17)28/h3-9,11H,1-2H3,(H,25,27)InChIKey
KMLNAZMBLZTHOM-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)C)C2=CSC(=C2C#N)NC(=O)C3=CC4=C(C=CC(=C4)(N+)(=O)(O))OC3=O
InChI=1SC23H15N3O5Sc1123413(2)16(712)19113222(18(19)1024)2521(27)17914815(26(29)30)5620(14)3123(17)28h3911H12H3(H2527)
MFCD06625227
N#Cc1c(scc1c1cc(C)ccc1C)NC(=O)c1cc2cc(ccc2oc1=O)(N+)(=O)(O)
N(3cyano4(25dimethylphenyl)thiophen2yl)6nitro2oxo2Hchromene3carboxamide
N(3CYANO4(25DIMETHYLPHENYL)THIOPHEN2YL)6NITRO2OXOCHROMENE3CARBOXAMIDE
N(4(25DIMETHYLPHENYL)3CYANO(2THIENYL))(6NITRO2OXOCHROMEN3YL)CARBOXAMIDE
ZINC000002872891
ZINC02872891
ZINC2872891
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