Vitas-M small molecule compound

2-({[(1E)-8-ethoxy-1-{2-[(5Z)-5-(2-methoxy-2-oxoethylidene)-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]hydrazinylidene}-4,4-dimethyl-2-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-6-yl]methyl}sulfanyl)benzoicacid

Catalog ID
STL584111
SMILES CCOc1cc2/C(=N\NC3=NC(=O)/C(=C/C(=O)OC)/S3)/C(=O)N3c2c(c1)C(=CC3(C)C)CSc1ccccc1C(=O)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 C29H26N4O7S2 MW 606.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4O7S2/c1-5-40-16-10-18-15(14-41-20-9-7-6-8-17(20)27(37)38)13-29(2,3)33-24(18)19(11-16)23(26(33)36)31-32-28-30-25(35)21(42-28)12-22(34)39-4/h6-13H,5,14H2,1-4H3,(H,37,38)(H,30,32,35)/b21-12-,31-23+
InChIKey
QCUWDVQTORHKLF-HXEGBXHASA-N
Synonyms

2((((1E)8ethoxy1(2((5Z)5(2methoxy2oxoethylidene)4oxo45dihydro13thiazol2yl)hydrazinylidene)44dimethyl2oxo12dihydro4Hpyrrolo(321ij)quinolin6yl)methyl)sulfanyl)benzoicacid
InChI=1SC29H26N4O7S2c154016101815(144120976817(20)27(37)38)1329(23)3324(18)19(1116)23(26(33)36)3132283025(35)21(4228)1222(34)394h613H514H214H3(H3738)(H303235)b21123123+

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Available files

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