Vitas-M small molecule compound
methyl (5Z)-5-[4-(dimethylamino)benzylidene]-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK017295
SMILES COC(=O)C1=C(Nc2ccccc2)S/C(=C\c2ccc(cc2)N(C)C)/C1=O
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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 C21H20N2O3S MW 380.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O3S/c1-23(2)16-11-9-14(10-12-16)13-17-19(24)18(21(25)26-3)20(27-17)22-15-7-5-4-6-8-15/h4-13,22H,1-3H3/b17-13-InChIKey
UTKGPDBGJIOKOB-LGMDPLHJSA-NSynonyms
CN(C)C1=CC=C(C=C1)C=C2C(=O)C(=C(S2)NC3=CC=CC=C3)C(=O)OC
COC(=O)C1=C(Nc2ccccc2)SC(=Cc2ccc(cc2)N(C)C)C1=O
InChI=1SC21H20N2O3Sc123(2)1611914(101216)131719(24)18(21(25)263)20(2717)22157546815h41322H13H3b1713
methyl(5Z)2anilino5((4(dimethylamino)phenyl)methylidene)4oxothiophene3carboxylate
METHYL(5Z)2ANILINO5((4DIMETHYLAMINOPHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
METHYL(5Z)5(4(DIMETHYLAMINO)BENZYLIDENE)4OXO2(PHENYLAMINO)45DIHYDROTHIOPHENE3CARBOXYLATE
MFCD02924658
STK017295
ZINC000001165794
ZINC01165794
ZINC1165794
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