Vitas-M small molecule compound
N-benzyl-2-({(E)-[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STL506182
SMILES Fc1ccc(cc1)n1c(C)cc(c1C)/C=N/c1sc2c(c1C(=O)NCc1ccccc1)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 C29H28FN3OS MW 485.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28FN3OS/c1-19-16-22(20(2)33(19)24-14-12-23(30)13-15-24)18-32-29-27(25-10-6-7-11-26(25)35-29)28(34)31-17-21-8-4-3-5-9-21/h3-5,8-9,12-16,18H,6-7,10-11,17H2,1-2H3,(H,31,34)/b32-18+InChIKey
FRKCRWDCYHKFPI-KCSSXMTESA-NSynonyms
~(N)benzyl2((~(E))(1(4fluorophenyl)25dimethylpyrrol3yl)methylideneamino)4567tetrahydro1benzothiophene3carboxamide
9652078
InChI=1SC29H28FN3OSc1191622(20(2)33(19)24141223(30)131524)18322927(2510671126(25)3529)28(34)3117218435921h3589121618H67101117H212H3(H3134)b3218+
MFCD02190685
Nbenzyl2(((E)(1(4fluorophenyl)25dimethyl1Hpyrrol3yl)methylidene)amino)4567tetrahydro1benzothiophene3carboxamide
ZINC000100116472
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