Vitas-M small molecule compound

methyl 2-{[(2-heptanoylhydrazinyl)carbonothioyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Catalog ID
STK436048
SMILES CCCCCCC(=O)NNC(=S)Nc1sc2c(c1C(=O)OC)CCC2

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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 C17H25N3O3S2 MW 383.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25N3O3S2/c1-3-4-5-6-10-13(21)19-20-17(24)18-15-14(16(22)23-2)11-8-7-9-12(11)25-15/h3-10H2,1-2H3,(H,19,21)(H2,18,20,24)
InChIKey
WVUFOROAZJBFBR-UHFFFAOYSA-N
Synonyms

CCCCCCC(=O)NNC(=S)NC1=C(C2=C(S1)CCC2)C(=O)OC
InChI=1SC17H25N3O3S2c134561013(21)192017(24)181514(16(22)232)1187912(11)2515h310H212H3(H1921)(H2182024)
METHYL2((((HEPTANOYLAMINO)AMINO)THIOXOMETHYL)AMINO)456TRIHYDROCYCLOPENTA(21B)THIOPHENE3CARBOXYLATE
methyl2(((2heptanoylhydrazinyl)carbonothioyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2((HEPTANOYLAMINO)CARBAMOTHIOYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD03944041
ZINC000006635144
ZINC06635144
ZINC6635144

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Available files

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