Vitas-M small molecule compound
methyl (4Z)-2-methyl-4-{[5-({[(4-methylphenyl)sulfonyl]amino}methyl)furan-2-yl]methylidene}-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK078074
SMILES COC(=O)C1=C(C)NC(=O)/C/1=C\c1ccc(o1)CNS(=O)(=O)c1ccc(cc1)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 C20H20N2O6S MW 416.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O6S/c1-12-4-8-16(9-5-12)29(25,26)21-11-15-7-6-14(28-15)10-17-18(20(24)27-3)13(2)22-19(17)23/h4-10,21H,11H2,1-3H3,(H,22,23)/b17-10-InChIKey
LWMLMAIPFFTIOA-YVLHZVERSA-NSynonyms
CC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(O2)C=C3C(=C(NC3=O)C)C(=O)OC
COC(=O)C1=C(C)NC(=O)C1=Cc1ccc(o1)CNS(=O)(=O)c1ccc(cc1)C
InChI=1SC20H20N2O6Sc1124816(9512)29(2526)2111157614(2815)101718(20(24)273)13(2)2219(17)23h41021H11H213H3(H2223)b1710
METHYL(4Z)2METHYL4((5((((4METHYLPHENYL)SULFONYL)AMINO)METHYL)FURAN2YL)METHYLIDENE)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)2METHYL4((5(((4METHYLPHENYL)SULFONYLAMINO)METHYL)FURAN2YL)METHYLIDENE)5OXO1HPYRROLE3CARBOXYLATE
MFCD08679487
STK078074
ZINC000013899586
ZINC13899586
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