Vitas-M small molecule compound
(2Z)-7-[(diethylammonio)methyl]-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK849258
SMILES CC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cccs1)/C2=O)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 C18H19NO3S MW 329.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO3S/c1-3-19(4-2)11-14-15(20)8-7-13-17(21)16(22-18(13)14)10-12-6-5-9-23-12/h5-10,20H,3-4,11H2,1-2H3/b16-10-InChIKey
IDOCEMKODKCACE-YBEGLDIGSA-NSynonyms
896808-10-9(2Z)7((diethylammonio)methyl)3oxo2(thiophen2ylmethylidene)23dihydro1benzofuran6olate
(2Z)7((diethylazaniumyl)methyl)3oxo2(thiophen2ylmethylidene)1benzofuran6olate
(2Z)7(DIETHYLAMINOMETHYL)6HYDROXY2(THIOPHEN2YLMETHYLIDENE)1BENZOFURAN3ONE
7((DIETHYLAMINO)METHYL)6HYDROXY2(2THIENYLMETHYLENE)BENZO(B)FURAN3ONE
896808109
CC(NH+)(CC)CC1=C(C=CC2=C1OC(=CC3=CC=CS3)C2=O)(O)
CC(NH+)(Cc1c((O))ccc2c1OC(=Cc1cccs1)C2=O)CC
InChI=1SC18H19NO3Sc1319(42)111415(20)871317(21)16(2218(13)14)10126592312h51020H3411H212H3b1610
MFCD06595815
ZINC000020504072
ZINC20504072
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