Vitas-M small molecule compound
N-phenyl-2-{[(E)-(2,3,4-trimethoxyphenyl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK385346
SMILES COc1c(OC)ccc(c1OC)/C=N/c1sc2c(c1C(=O)Nc1ccccc1)CCCC2
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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 C25H26N2O4S MW 450.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O4S/c1-29-19-14-13-16(22(30-2)23(19)31-3)15-26-25-21(18-11-7-8-12-20(18)32-25)24(28)27-17-9-5-4-6-10-17/h4-6,9-10,13-15H,7-8,11-12H2,1-3H3,(H,27,28)/b26-15+InChIKey
YZXXZWWACQHARV-CVKSISIWSA-NSynonyms
COC1=C(C(=C(C=C1)C=NC2=C(C3=C(S2)CCCC3)C(=O)NC4=CC=CC=C4)OC)OC
COc1c(OC)ccc(c1OC)C=Nc1sc2c(c1C(=O)Nc1ccccc1)CCCC2
InChI=1SC25H26N2O4Sc12919141316(22(302)23(19)313)15262521(1811781220(18)3225)24(28)271795461017h469101315H781112H213H3(H2728)b2615+
MFCD03274005
Nphenyl2(((E)(234trimethoxyphenyl)methylidene)amino)4567tetrahydro1benzothiophene3carboxamide
Nphenyl2((E)(234trimethoxyphenyl)methylideneamino)4567tetrahydro1benzothiophene3carboxamide
ZINC000015946411
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