Vitas-M small molecule compound

1-acetyl-N-[3-carbamoyl-4-(4-ethylphenyl)-5-methylthiophen-2-yl]piperidine-4-carboxamide

Catalog ID
STK480866
SMILES CCc1ccc(cc1)c1c(C)sc(c1C(=O)N)NC(=O)C1CCN(CC1)C(=O)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 C22H27N3O3S MW 413.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O3S/c1-4-15-5-7-16(8-6-15)18-13(2)29-22(19(18)20(23)27)24-21(28)17-9-11-25(12-10-17)14(3)26/h5-8,17H,4,9-12H2,1-3H3,(H2,23,27)(H,24,28)
InChIKey
DXIJVFMRSULEAF-UHFFFAOYSA-N
Synonyms

1acetylN(3carbamoyl4(4ethylphenyl)5methylthiophen2yl)piperidine4carboxamide
2((1ACETYL(4PIPERIDYL))CARBONYLAMINO)4(4ETHYLPHENYL)5METHYLTHIOPHENE3CARBOXAMIDE
CCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)N)NC(=O)C3CCN(CC3)C(=O)C)C
InChI=1SC22H27N3O3Sc14155716(8615)1813(2)2922(19(18)20(23)27)2421(28)1791125(121017)14(3)26h5817H4912H213H3(H22327)(H2428)
MFCD08071728
ZINC000006730690
ZINC06730690
ZINC6730690

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Available files

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