Vitas-M small molecule compound
N-benzyl-2-({(E)-[1-(2-fluorobenzyl)-1H-indol-3-yl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK048415
SMILES O=C(c1c(/N=C/c2cn(c3c2cccc3)Cc2ccccc2F)sc2c1CCCC2)NCc1ccccc1
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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 C32H28FN3OS MW 521.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28FN3OS/c33-27-15-7-4-12-23(27)20-36-21-24(25-13-5-8-16-28(25)36)19-35-32-30(26-14-6-9-17-29(26)38-32)31(37)34-18-22-10-2-1-3-11-22/h1-5,7-8,10-13,15-16,19,21H,6,9,14,17-18,20H2,(H,34,37)/b35-19+InChIKey
PNRLLEOKRRLQSO-XZYGTATASA-NSynonyms
C1CCC2=C(C1)C(=C(S2)N=CC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5F)C(=O)NCC6=CC=CC=C6
InChI=1SC32H28FN3OSc332715741223(27)20362124(2513581628(25)36)19353230(2614691729(26)3832)31(37)341822102131122h1578101315161921H6914171820H2(H3437)b3519+
MFCD02794529
Nbenzyl2(((E)(1(2fluorobenzyl)1Hindol3yl)methylidene)amino)4567tetrahydro1benzothiophene3carboxamide
Nbenzyl2((E)(1((2fluorophenyl)methyl)indol3yl)methylideneamino)4567tetrahydro1benzothiophene3carboxamide
O=C(c1c(N=Cc2cn(c3c2cccc3)Cc2ccccc2F)sc2c1CCCC2)NCc1ccccc1
STK048415
ZINC000009434506
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