Vitas-M small molecule compound
methyl 4-(3,4-dimethylphenyl)-2-{[(4-methoxy-3-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK453283
SMILES COC(=O)c1c(scc1c1ccc(c(c1)C)C)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 C22H20N2O6S MW 440.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O6S/c1-12-5-6-14(9-13(12)2)16-11-31-21(19(16)22(26)30-4)23-20(25)15-7-8-18(29-3)17(10-15)24(27)28/h5-11H,1-4H3,(H,23,25)InChIKey
PRFJTOBMEQTZGK-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3=CC(=C(C=C3)OC)(N+)(=O)(O))C
COC(=O)c1c(scc1c1ccc(c(c1)C)C)NC(=O)c1ccc(c(c1)(N+)(=O)(O))OC
InChI=1SC22H20N2O6Sc1125614(913(12)2)16113121(19(16)22(26)304)2320(25)157818(293)17(1015)24(27)28h511H14H3(H2325)
methyl4(34dimethylphenyl)2(((4methoxy3nitrophenyl)carbonyl)amino)thiophene3carboxylate
METHYL4(34DIMETHYLPHENYL)2((3NITRO4METHOXYBENZOYL)AMINO)3THIOPHENECARBOXYLATE
METHYL4(34DIMETHYLPHENYL)2((4METHOXY3NITROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
METHYL4(34DIMETHYLPHENYL)2((4METHOXY3NITROPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
MFCD02607187
ZINC000000675838
ZINC00675838
ZINC675838
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