Vitas-M small molecule compound
(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl 2-methylbenzoate
Catalog ID
STK923726
SMILES O=C1/C(=C/c2cccs2)/Oc2c1ccc(c2)OC(=O)c1ccccc1C
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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 C21H14O4S MW 362.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14O4S/c1-13-5-2-3-7-16(13)21(23)24-14-8-9-17-18(11-14)25-19(20(17)22)12-15-6-4-10-26-15/h2-12H,1H3/b19-12-InChIKey
XQIUNJPVBZZSAQ-UNOMPAQXSA-NSynonyms
847183-18-0((2Z)3OXO2(THIOPHEN2YLMETHYLIDENE)1BENZOFURAN6YL)2METHYLBENZOATE
(2Z)3oxo2(thiophen2ylmethylidene)23dihydro1benzofuran6yl2methylbenzoate
(Z)3oxo2(thiophen2ylmethylene)23dihydrobenzofuran6yl2methylbenzoate
3OXO2(2THIENYLMETHYLENE)BENZO(34B)FURAN6YL2METHYLBENZOATE
847183180
CC1=CC=CC=C1C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC=CS4)O3
InChI=1SC21H14O4Sc113523716(13)21(23)2414891718(1114)2519(20(17)22)121564102615h212H1H3b1912
MFCD04184565
O=C1C(=Cc2cccs2)Oc2c1ccc(c2)OC(=O)c1ccccc1C
ZINC000005164640
ZINC05164640
ZINC5164640
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