Vitas-M small molecule compound
6-tert-butyl-N-(3-chlorophenyl)-2-{[(E)-(4-ethoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK385144
SMILES CCOc1ccc(cc1)/C=N/c1sc2c(c1C(=O)Nc1cccc(c1)Cl)CCC(C2)C(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 C28H31ClN2O2S MW 495.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31ClN2O2S/c1-5-33-22-12-9-18(10-13-22)17-30-27-25(26(32)31-21-8-6-7-20(29)16-21)23-14-11-19(28(2,3)4)15-24(23)34-27/h6-10,12-13,16-17,19H,5,11,14-15H2,1-4H3,(H,31,32)/b30-17+InChIKey
GTXFCQFEGMVICU-OCSSWDANSA-NSynonyms
6tertbutylN(3chlorophenyl)2(((E)(4ethoxyphenyl)methylidene)amino)4567tetrahydro1benzothiophene3carboxamide
6tertbutylN(3chlorophenyl)2((E)(4ethoxyphenyl)methylideneamino)4567tetrahydro1benzothiophene3carboxamide
CCOC1=CC=C(C=C1)C=NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C(=O)NC4=CC(=CC=C4)Cl
CCOc1ccc(cc1)C=Nc1sc2c(c1C(=O)Nc1cccc(c1)Cl)CCC(C2)C(C)(C)C
InChI=1SC28H31ClN2O2Sc15332212918(101322)17302725(26(32)312186720(29)1621)23141119(28(23)4)1524(23)3427h6101213161719H5111415H214H3(H3132)b3017+
MFCD03613652
ZINC000015946138
ZINC000015946140
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