Vitas-M small molecule compound

methyl 2-[(3-chloropropanoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Catalog ID
STK419409
SMILES ClCCC(=O)Nc1sc2c(c1C(=O)OC)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 C14H18ClNO3S MW 315.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18ClNO3S/c1-19-14(18)12-9-5-3-2-4-6-10(9)20-13(12)16-11(17)7-8-15/h2-8H2,1H3,(H,16,17)
InChIKey
UAOSOHAFCDHZNU-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(SC2=C1CCCCC2)NC(=O)CCCl
InChI=1SC14H18ClNO3Sc11914(18)1295324610(9)2013(12)1611(17)7815h28H21H3(H1617)
methyl2((3chloropropanoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2(3chloropropanoylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD01350986
ZINC000004099625
ZINC04099625
ZINC4099625

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.