Vitas-M small molecule compound
6-{[3-(methoxycarbonyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK400465
SMILES COC(=O)c1c(NC(=O)C2CC=CCC2C(=O)O)sc2c1CCCCC2
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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 C19H23NO5S MW 377.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23NO5S/c1-25-19(24)15-13-9-3-2-4-10-14(13)26-17(15)20-16(21)11-7-5-6-8-12(11)18(22)23/h5-6,11-12H,2-4,7-10H2,1H3,(H,20,21)(H,22,23)InChIKey
ITTIIEUOMHMQAO-UHFFFAOYSA-NSynonyms
6((3(methoxycarbonyl)5678tetrahydro4Hcyclohepta(b)thiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
6((3methoxycarbonyl5678tetrahydro4Hcyclohepta(b)thiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
COC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3CC=CCC3C(=O)O
InChI=1SC19H23NO5Sc12519(24)151393241014(13)2617(15)2016(21)11756812(11)18(22)23h561112H24710H21H3(H2021)(H2223)
MFCD01921753
ZINC000004614206
ZINC000004614209
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