Vitas-M small molecule compound
1-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-8-methoxy-4,4,6-trimethyl-2-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1-yl ethanimidothioate
Catalog ID
STK789534
SMILES COc1cc2C(=CC(N3c2c(c1)C(SC(=N)C)(C1=C(O)CC(CC1=O)(C)C)C3=O)(C)C)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 C25H30N2O4S MW 454.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O4S/c1-13-10-24(5,6)27-21-16(13)8-15(31-7)9-17(21)25(22(27)30,32-14(2)26)20-18(28)11-23(3,4)12-19(20)29/h8-10,26,28H,11-12H2,1-7H3/b26-14-InChIKey
FCYHBHXMJSYNLP-WGARJPEWSA-NSynonyms
1(2hydroxy44dimethyl6oxocyclohex1en1yl)8methoxy446trimethyl2oxo12dihydro4Hpyrrolo(321ij)quinolin1ylethanimidothioate
1(2hydroxy44dimethyl6oxocyclohex1en1yl)8methoxy446trimethyl2oxo24dihydro1Hpyrrolo(321ij)quinolin1ylethanimidothioate
MFCD06607762
ZINC000009124271
ZINC000013282725
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