Vitas-M small molecule compound

1-methyl-3-thioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide

Catalog ID
STL109883
SMILES NC(=O)c1c(=S)[nH]c(c2c1CCCC2)C

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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 C11H14N2OS MW 222.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H14N2OS/c1-6-7-4-2-3-5-8(7)9(10(12)14)11(15)13-6/h2-5H2,1H3,(H2,12,14)(H,13,15)
InChIKey
BHXUBVDVMHZHOF-UHFFFAOYSA-N
Synonyms

1methyl3sulfanylidene5678tetrahydro2Hisoquinoline4carboxamide
1methyl3thioxo235678hexahydroisoquinoline4carboxamide
CC1=C2CCCCC2=C(C(=S)N1)C(=O)N
InChI=1SC11H14N2OSc16742358(7)9(10(12)14)11(15)136h25H21H3(H21214)(H1315)
MFCD20737308
NC(=O)c1c(=S)(nH)c(c2c1CCCC2)C
ZINC000067257800
ZINC67257800

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Available files

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