Vitas-M small molecule compound
4-nitro-N-[4-oxo-3-(thiophen-2-yl)-4H-thiochromen-2-yl]benzamide
Catalog ID
STK828999
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])Nc1sc2ccccc2c(=O)c1c1cccs1
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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 C20H12N2O4S2 MW 408.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12N2O4S2/c23-18-14-4-1-2-5-15(14)28-20(17(18)16-6-3-11-27-16)21-19(24)12-7-9-13(10-8-12)22(25)26/h1-11H,(H,21,24)InChIKey
XNKWRPYXIUFOQR-UHFFFAOYSA-NSynonyms
879449-49-74nitroN(4oxo3(thiophen2yl)4Hthiochromen2yl)benzamide
4NITRON(4OXO3THIOPHEN2YLTHIOCHROMEN2YL)BENZAMIDE
879449497
C1=CC=C2C(=C1)C(=O)C(=C(S2)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O))C4=CC=CS4
InChI=1SC20H12N2O4S2c231814412515(14)2820(17(18)1663112716)2119(24)127913(10812)22(25)26h111H(H2124)
MFCD06794343
O=C(c1ccc(cc1)(N+)(=O)(O))Nc1sc2ccccc2c(=O)c1c1cccs1
ZINC000101192601
ZINC101192601
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