Vitas-M small molecule compound
2-{[(2E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino}-N-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK798495
SMILES CNC(=O)c1c(NC(=O)/C=C/c2ccc(cc2)C(C)(C)C)sc2c1CCCC2
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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 C23H28N2O2S MW 396.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O2S/c1-23(2,3)16-12-9-15(10-13-16)11-14-19(26)25-22-20(21(27)24-4)17-7-5-6-8-18(17)28-22/h9-14H,5-8H2,1-4H3,(H,24,27)(H,25,26)/b14-11+InChIKey
QNGUFBJPKUGMFT-SDNWHVSQSA-NSynonyms
2(((2E)3(4tertbutylphenyl)prop2enoyl)amino)Nmethyl4567tetrahydro1benzothiophene3carboxamide
2(((E)3(4tertbutylphenyl)prop2enoyl)amino)Nmethyl4567tetrahydro1benzothiophene3carboxamide
CC(C)(C)C1=CC=C(C=C1)C=CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NC
CNC(=O)c1c(NC(=O)C=Cc2ccc(cc2)C(C)(C)C)sc2c1CCCC2
InChI=1SC23H28N2O2Sc123(23)1612915(101316)111419(26)252220(21(27)244)17756818(17)2822h914H58H214H3(H2427)(H2526)b1411+
MFCD03461992
ZINC000002668297
ZINC02668297
ZINC2668297
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