Vitas-M small molecule compound

2-methoxy-5-[(Z)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenyl 4-methylbenzoate

Catalog ID
STK899344
SMILES COc1ccc(cc1OC(=O)c1ccc(cc1)C)/C=c/1\sc2n(c1=O)c1c(n2)cccc1

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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 C25H18N2O4S MW 442.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N2O4S/c1-15-7-10-17(11-8-15)24(29)31-21-13-16(9-12-20(21)30-2)14-22-23(28)27-19-6-4-3-5-18(19)26-25(27)32-22/h3-14H,1-2H3/b22-14-
InChIKey
SEAZSNYPPBLOJL-HMAPJEAMSA-N
Synonyms

(2methoxy5((Z)(1oxo(13)thiazolo(32a)benzimidazol2ylidene)methyl)phenyl)4methylbenzoate
2methoxy5((Z)(3oxo(13)thiazolo(32a)benzimidazol2(3H)ylidene)methyl)phenyl4methylbenzoate
CC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)C=C3C(=O)N4C5=CC=CC=C5N=C4S3)OC
COc1ccc(cc1OC(=O)c1ccc(cc1)C)C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC25H18N2O4Sc11571017(11815)24(29)31211316(91220(21)302)142223(28)2719643518(19)2625(27)3222h314H12H3b2214
MFCD20731740
ZINC000035656636
ZINC35656636

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Available files

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