Vitas-M small molecule compound
methyl [3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamate
Catalog ID
STK453346
SMILES COC(=O)Nc1sc2c(c1C#N)CCC(C2)C(CC)(C)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 C16H22N2O2S MW 306.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O2S/c1-5-16(2,3)10-6-7-11-12(9-17)14(18-15(19)20-4)21-13(11)8-10/h10H,5-8H2,1-4H3,(H,18,19)InChIKey
IJNCHJFTPLPKRG-UHFFFAOYSA-NSynonyms
CCC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)OC
InChI=1SC16H22N2O2Sc1516(23)10671112(917)14(1815(19)204)2113(11)810h10H58H214H3(H1819)
methyl(3cyano6(2methylbutan2yl)4567tetrahydro1benzothiophen2yl)carbamate
methylN(3cyano6(2methylbutan2yl)4567tetrahydro1benzothiophen2yl)carbamate
MFCD03387542
ZINC000002771531
ZINC000002771532
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