Vitas-M small molecule compound
methyl 2-{[(3-bromophenyl)carbonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK419126
SMILES COC(=O)c1c(NC(=O)c2cccc(c2)Br)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 C19H20BrNO3S MW 422.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BrNO3S/c1-24-19(23)16-14-9-4-2-3-5-10-15(14)25-18(16)21-17(22)12-7-6-8-13(20)11-12/h6-8,11H,2-5,9-10H2,1H3,(H,21,22)InChIKey
KFBSLFSNSQHCAR-UHFFFAOYSA-NSynonyms
352687-00-4352687004
COC(=O)C1=C(SC2=C1CCCCCC2)NC(=O)C3=CC(=CC=C3)Br
InChI=1SC19H20BrNO3Sc12419(23)1614942351015(14)2518(16)2117(22)1276813(20)1112h6811H25910H21H3(H2122)
methyl2(((3bromophenyl)carbonyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2((3bromobenzoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD01353973
ZINC000002741506
ZINC02741506
ZINC2741506
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