Vitas-M small molecule compound
2-({(2E)-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}amino)-N-(tetrahydrofuran-2-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK823625
SMILES O=C(Nc1sc2c(c1C(=O)NCC1CCCO1)CCCC2)/C=C/c1ccc(cc1)C(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 C26H32N2O3S MW 452.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N2O3S/c1-17(2)19-12-9-18(10-13-19)11-14-23(29)28-26-24(21-7-3-4-8-22(21)32-26)25(30)27-16-20-6-5-15-31-20/h9-14,17,20H,3-8,15-16H2,1-2H3,(H,27,30)(H,28,29)/b14-11+InChIKey
TWVHVQULIGBXJJ-SDNWHVSQSA-NSynonyms
2(((2E)3(4(propan2yl)phenyl)prop2enoyl)amino)N(tetrahydrofuran2ylmethyl)4567tetrahydro1benzothiophene3carboxamide
CC(C)C1=CC=C(C=C1)C=CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCC4CCCO4
InChI=1SC26H32N2O3Sc117(2)1912918(101319)111423(29)282624(21734822(21)3226)25(30)27162065153120h9141720H381516H212H3(H2730)(H2829)b1411+
MFCD03464125
N(oxolan2ylmethyl)2(((E)3(4propan2ylphenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxamide
O=C(Nc1sc2c(c1C(=O)NCC1CCCO1)CCCC2)C=Cc1ccc(cc1)C(C)C
ZINC000027020416
ZINC000027020421
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