Vitas-M small molecule compound

methyl 2-{[(3-methoxypropyl)carbamothioyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK456138
SMILES COCCCNC(=S)Nc1sc2c(c1C(=O)OC)CCC(C2)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 C16H24N2O3S2 MW 356.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H24N2O3S2/c1-10-5-6-11-12(9-10)23-14(13(11)15(19)21-3)18-16(22)17-7-4-8-20-2/h10H,4-9H2,1-3H3,(H2,17,18,22)
InChIKey
ZWGZWNOTJBYQFS-UHFFFAOYSA-N
Synonyms

CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=S)NCCCOC
InChI=1SC16H24N2O3S2c110561112(910)2314(13(11)15(19)213)1816(22)17748202h10H49H213H3(H2171822)
methyl2(((3methoxypropyl)carbamothioyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
methyl2(3methoxypropylcarbamothioylamino)6methyl4567tetrahydro1benzothiophene3carboxylate
MFCD04286515
ZINC000002855600
ZINC000002855601

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Available files

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