Vitas-M small molecule compound
6-tert-butyl-2-{[(E)-phenylmethylidene]amino}-N-[3-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK385168
SMILES O=C(c1c(/N=C/c2ccccc2)sc2c1CCC(C2)C(C)(C)C)Nc1cccc(c1)C(F)(F)F
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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 C27H27F3N2OS MW 484.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27F3N2OS/c1-26(2,3)18-12-13-21-22(15-18)34-25(31-16-17-8-5-4-6-9-17)23(21)24(33)32-20-11-7-10-19(14-20)27(28,29)30/h4-11,14,16,18H,12-13,15H2,1-3H3,(H,32,33)/b31-16+InChIKey
BQMLGCNPSALFEJ-WCMJOSRZSA-NSynonyms
2((E)benzylideneamino)6tertbutylN(3(trifluoromethyl)phenyl)4567tetrahydro1benzothiophene3carboxamide
6tertbutyl2(((E)phenylmethylidene)amino)N(3(trifluoromethyl)phenyl)4567tetrahydro1benzothiophene3carboxamide
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3=CC=CC(=C3)C(F)(F)F)N=CC4=CC=CC=C4
InChI=1SC27H27F3N2OSc126(23)1812132122(1518)3425(3116178546917)23(21)24(33)32201171019(1420)27(2829)30h411141618H121315H213H3(H3233)b3116+
MFCD03274044
O=C(c1c(N=Cc2ccccc2)sc2c1CCC(C2)C(C)(C)C)Nc1cccc(c1)C(F)(F)F
ZINC000015946504
ZINC000015946506
Check stock
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