Vitas-M small molecule compound

6-tert-butyl-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-{[(2E)-3-(furan-2-yl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STK906567
SMILES O=C(Nc1sc2c(c1C(=O)NC1CCS(=O)(=O)C1)CCC(C2)C(C)(C)C)/C=C/c1ccco1

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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 C24H30N2O5S2 MW 490.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N2O5S2/c1-24(2,3)15-6-8-18-19(13-15)32-23(26-20(27)9-7-17-5-4-11-31-17)21(18)22(28)25-16-10-12-33(29,30)14-16/h4-5,7,9,11,15-16H,6,8,10,12-14H2,1-3H3,(H,25,28)(H,26,27)/b9-7+
InChIKey
JWIPWAZAWISCMP-VQHVLOKHSA-N
Synonyms
844853-05-0
(E)6(tertbutyl)N(11dioxidotetrahydrothiophen3yl)2(3(furan2yl)acrylamido)4567tetrahydrobenzo(b)thiophene3carboxamide
6tertbutylN(11dioxidotetrahydrothiophen3yl)2(((2E)3(furan2yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxamide
6tertbutylN(11dioxothiolan3yl)2(((E)3(furan2yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxamide
844853050
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3CCS(=O)(=O)C3)NC(=O)C=CC4=CC=CO4
InChI=1SC24H30N2O5S2c124(23)15681819(1315)3223(2620(27)971754113117)21(18)22(28)2516101233(2930)1416h4579111516H68101214H213H3(H2528)(H2627)b97+
MFCD04164567
O=C(Nc1sc2c(c1C(=O)NC1CCS(=O)(=O)C1)CCC(C2)C(C)(C)C)C=Cc1ccco1
ZINC000009281076
ZINC000009281080

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Available files

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