Vitas-M small molecule compound
3,6-dichloro-N-(4-methoxy-3-nitrophenyl)-1-benzothiophene-2-carboxamide
Catalog ID
STK220453
SMILES COc1ccc(cc1[N+](=O)[O-])NC(=O)c1sc2c(c1Cl)ccc(c2)Cl
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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 C16H10Cl2N2O4S MW 397.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10Cl2N2O4S/c1-24-12-5-3-9(7-11(12)20(22)23)19-16(21)15-14(18)10-4-2-8(17)6-13(10)25-15/h2-7H,1H3,(H,19,21)InChIKey
DFXUKRBNVISATE-UHFFFAOYSA-NSynonyms
36dichloroN(4methoxy3nitrophenyl)1benzothiophene2carboxamide
COC1=C(C=C(C=C1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))NC(=O)c1sc2c(c1Cl)ccc(c2)Cl
InChI=1SC16H10Cl2N2O4Sc12412539(711(12)20(22)23)1916(21)1514(18)10428(17)613(10)2515h27H1H3(H1921)
MFCD05799757
ZINC000004815470
ZINC04815470
ZINC4815470
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