Vitas-M small molecule compound
propan-2-yl 5-carbamoyl-2-[({4-[(4-fluorophenyl)sulfonyl]piperazin-1-yl}acetyl)amino]-4-methylthiophene-3-carboxylate
Catalog ID
STK458895
SMILES O=C(Nc1sc(c(c1C(=O)OC(C)C)C)C(=O)N)CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)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 C22H27FN4O6S2 MW 526.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27FN4O6S2/c1-13(2)33-22(30)18-14(3)19(20(24)29)34-21(18)25-17(28)12-26-8-10-27(11-9-26)35(31,32)16-6-4-15(23)5-7-16/h4-7,13H,8-12H2,1-3H3,(H2,24,29)(H,25,28)InChIKey
SGKQSLFLEQLCII-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)C(=O)N
InChI=1SC22H27FN4O6S2c113(2)3322(30)1814(3)19(20(24)29)3421(18)2517(28)122681027(11926)35(3132)166415(23)5716h4713H812H213H3(H22429)(H2528)
METHYLETHYL5CARBAMOYL2(2(4((4FLUOROPHENYL)SULFONYL)PIPERAZINYL)ACETYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD05123197
propan2yl5carbamoyl2(((4((4fluorophenyl)sulfonyl)piperazin1yl)acetyl)amino)4methylthiophene3carboxylate
propan2yl5carbamoyl2((2(4(4fluorophenyl)sulfonylpiperazin1yl)acetyl)amino)4methylthiophene3carboxylate
ZINC000020294999
ZINC20294999
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