Vitas-M small molecule compound
N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2,4-dimethoxybenzamide
Catalog ID
STK957386
SMILES COc1ccc(c(c1)OC)C(=O)Nc1sc2c(c1C#N)CCCCC2
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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 C19H20N2O3S MW 356.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O3S/c1-23-12-8-9-14(16(10-12)24-2)18(22)21-19-15(11-20)13-6-4-3-5-7-17(13)25-19/h8-10H,3-7H2,1-2H3,(H,21,22)InChIKey
VKDYYOJFWKESLI-UHFFFAOYSA-NSynonyms
COC1=CC(=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCCC3)C#N)OC
InChI=1SC19H20N2O3Sc123128914(16(1012)242)18(22)211915(1120)136435717(13)2519h810H37H212H3(H2122)
MFCD01349967
N(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)24dimethoxybenzamide
ZINC000002739091
ZINC02739091
ZINC2739091
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