Vitas-M small molecule compound
methyl 2-[({1-ethyl-3-[(2-methoxyethyl)carbamoyl]-1H-pyrazol-4-yl}carbamothioyl)amino]-5-phenylthiophene-3-carboxylate
Catalog ID
STK447357
SMILES COCCNC(=O)c1nn(cc1NC(=S)Nc1sc(cc1C(=O)OC)c1ccccc1)CC
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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 C22H25N5O4S2 MW 487.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O4S2/c1-4-27-13-16(18(26-27)19(28)23-10-11-30-2)24-22(32)25-20-15(21(29)31-3)12-17(33-20)14-8-6-5-7-9-14/h5-9,12-13H,4,10-11H2,1-3H3,(H,23,28)(H2,24,25,32)InChIKey
LOLJHQLALMEKAK-UHFFFAOYSA-NSynonyms
CCN1C=C(C(=N1)C(=O)NCCOC)NC(=S)NC2=C(C=C(S2)C3=CC=CC=C3)C(=O)OC
InChI=1SC22H25N5O4S2c14271316(18(2627)19(28)231011302)2422(32)252015(21(29)313)1217(3320)148657914h591213H41011H213H3(H2328)(H2242532)
METHYL2((((1ETHYL3(N(2METHOXYETHYL)CARBAMOYL)PYRAZOL4YL)AMINO)THIOXOMETHYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
methyl2(((1ethyl3((2methoxyethyl)carbamoyl)1Hpyrazol4yl)carbamothioyl)amino)5phenylthiophene3carboxylate
methyl2((1ethyl3(2methoxyethylcarbamoyl)pyrazol4yl)carbamothioylamino)5phenylthiophene3carboxylate
MFCD04059597
ZINC000020215291
ZINC20215291
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