Vitas-M small molecule compound
methyl 4-(4-methoxyphenyl)-5-methyl-2-{[(3-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK452391
SMILES COC(=O)c1c(sc(c1c1ccc(cc1)OC)C)NC(=O)c1cccc(c1)[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 C21H18N2O6S MW 426.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O6S/c1-12-17(13-7-9-16(28-2)10-8-13)18(21(25)29-3)20(30-12)22-19(24)14-5-4-6-15(11-14)23(26)27/h4-11H,1-3H3,(H,22,24)InChIKey
IAOXGRRPJWQQSX-UHFFFAOYSA-NSynonyms
CC1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)(N+)(=O)(O))C(=O)OC)C3=CC=C(C=C3)OC
COC(=O)c1c(sc(c1c1ccc(cc1)OC)C)NC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC21H18N2O6Sc11217(137916(282)10813)18(21(25)293)20(3012)2219(24)1454615(1114)23(26)27h411H13H3(H2224)
METHYL2((3NITROBENZOYL)AMINO)4(4METHOXYPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
methyl4(4methoxyphenyl)5methyl2(((3nitrophenyl)carbonyl)amino)thiophene3carboxylate
METHYL4(4METHOXYPHENYL)5METHYL2((3NITROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
METHYL4(4METHOXYPHENYL)5METHYL2((3NITROPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
MFCD02607507
ZINC000000685834
ZINC00685834
ZINC685834
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