Vitas-M small molecule compound
methyl 2-{[(3,5-dinitrophenyl)carbonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK731369
SMILES COC(=O)c1c(NC(=O)c2cc(cc(c2)[N+](=O)[O-])[N+](=O)[O-])sc2c1CCCCCC2
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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 C19H19N3O7S MW 433.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O7S/c1-29-19(24)16-14-6-4-2-3-5-7-15(14)30-18(16)20-17(23)11-8-12(21(25)26)10-13(9-11)22(27)28/h8-10H,2-7H2,1H3,(H,20,23)InChIKey
HBLURSCOOLEIOV-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCCCC2)NC(=O)C3=CC(=CC(=C3)(N+)(=O)(O))(N+)(=O)(O)
COC(=O)c1c(NC(=O)c2cc(cc(c2)(N+)(=O)(O))(N+)(=O)(O))sc2c1CCCCCC2
InChI=1SC19H19N3O7Sc12919(24)161464235715(14)3018(16)2017(23)11812(21(25)26)1013(911)22(27)28h810H27H21H3(H2023)
methyl2(((35dinitrophenyl)carbonyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2((35dinitrobenzoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD01356761
ZINC000003669394
ZINC03669394
ZINC3669394
Check stock
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