Vitas-M small molecule compound
methyl 2-{[(4-methoxy-3-nitrophenyl)carbonyl]amino}-4-(4-methoxyphenyl)-5-methylthiophene-3-carboxylate
Catalog ID
STK453285
SMILES COc1ccc(cc1)c1c(C)sc(c1C(=O)OC)NC(=O)c1ccc(c(c1)[N+](=O)[O-])OC
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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 C22H20N2O7S MW 456.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O7S/c1-12-18(13-5-8-15(29-2)9-6-13)19(22(26)31-4)21(32-12)23-20(25)14-7-10-17(30-3)16(11-14)24(27)28/h5-11H,1-4H3,(H,23,25)InChIKey
ZGYRHEYZHLVALU-UHFFFAOYSA-NSynonyms
CC1=C(C(=C(S1)NC(=O)C2=CC(=C(C=C2)OC)(N+)(=O)(O))C(=O)OC)C3=CC=C(C=C3)OC
COc1ccc(cc1)c1c(C)sc(c1C(=O)OC)NC(=O)c1ccc(c(c1)(N+)(=O)(O))OC
InChI=1SC22H20N2O7Sc11218(135815(292)9613)19(22(26)314)21(3212)2320(25)1471017(303)16(1114)24(27)28h511H14H3(H2325)
methyl2(((4methoxy3nitrophenyl)carbonyl)amino)4(4methoxyphenyl)5methylthiophene3carboxylate
METHYL2((3NITRO4METHOXYBENZOYL)AMINO)4(4METHOXYPHENYL)5METHYL3THIOPHENECARBOXYLATE
METHYL2((4METHOXY3NITROBENZOYL)AMINO)4(4METHOXYPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
METHYL2((4METHOXY3NITROPHENYL)CARBONYLAMINO)4(4METHOXYPHENYL)5METHYLTHIOPHENE3CARBOXYLATE
MFCD02606981
ZINC000000668876
ZINC00668876
ZINC668876
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