Vitas-M small molecule compound
propan-2-yl 2-{[(2E)-3-(1,5-dimethyl-1H-pyrazol-4-yl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK317529
SMILES CC(OC(=O)c1c(NC(=O)/C=C/c2cnn(c2C)C)sc2c1CCCC2)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 C20H25N3O3S MW 387.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O3S/c1-12(2)26-20(25)18-15-7-5-6-8-16(15)27-19(18)22-17(24)10-9-14-11-21-23(4)13(14)3/h9-12H,5-8H2,1-4H3,(H,22,24)/b10-9+InChIKey
TVXBMWZHYNAGFU-MDZDMXLPSA-NSynonyms
515857-82-6515857826
CC(OC(=O)c1c(NC(=O)C=Cc2cnn(c2C)C)sc2c1CCCC2)C
CC1=C(C=NN1C)C=CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC(C)C
InChI=1SC20H25N3O3Sc112(2)2620(25)1815756816(15)2719(18)2217(24)10914112123(4)13(14)3h912H58H214H3(H2224)b109+
MFCD02244030
propan2yl2(((2E)3(15dimethyl1Hpyrazol4yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
propan2yl2(((E)3(15dimethylpyrazol4yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000000656806
ZINC00656806
ZINC656806
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