Vitas-M small molecule compound
propyl 4-(4-tert-butylphenyl)-2-{[(4-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STL174144
SMILES CCCOC(=O)c1c(scc1c1ccc(cc1)C(C)(C)C)NC(=O)c1ccc(cc1)[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 C25H26N2O5S MW 466.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O5S/c1-5-14-32-24(29)21-20(16-6-10-18(11-7-16)25(2,3)4)15-33-23(21)26-22(28)17-8-12-19(13-9-17)27(30)31/h6-13,15H,5,14H2,1-4H3,(H,26,28)InChIKey
OOLWRDFHQOAQEA-UHFFFAOYSA-NSynonyms
514854-53-6514854536
CCCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C(C)(C)C)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
CCCOC(=O)c1c(scc1c1ccc(cc1)C(C)(C)C)NC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H26N2O5Sc15143224(29)2120(1661018(11716)25(23)4)153323(21)2622(28)1781219(13917)27(30)31h61315H514H214H3(H2628)
MFCD02372797
propyl4(4tertbutylphenyl)2(((4nitrophenyl)carbonyl)amino)thiophene3carboxylate
PROPYL4(4TERTBUTYLPHENYL)2((4NITROBENZOYL)AMINO)3THIOPHENECARBOXYLATE
PROPYL4(4TERTBUTYLPHENYL)2((4NITROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
ZINC000002090052
ZINC02090052
ZINC2090052
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