Vitas-M small molecule compound

3-[(E)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenyl 4-methylbenzenesulfonate

Catalog ID
STK804665
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1cccc(c1)/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 C23H16N2O4S2 MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N2O4S2/c1-15-9-11-18(12-10-15)31(27,28)29-17-6-4-5-16(13-17)14-21-22(26)25-20-8-3-2-7-19(20)24-23(25)30-21/h2-14H,1H3/b21-14+
InChIKey
RFXXHHHJIJRCEM-KGENOOAVSA-N
Synonyms
359432-06-7
(3((E)(1OXO(13)THIAZOLO(32A)BENZIMIDAZOL2YLIDENE)METHYL)PHENYL)4METHYLBENZENESULFONATE
(E)3((3oxobenzo(45)imidazo(21b)thiazol2(3H)ylidene)methyl)phenyl4methylbenzenesulfonate
3((E)(3oxo(13)thiazolo(32a)benzimidazol2(3H)ylidene)methyl)phenyl4methylbenzenesulfonate
359432067
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)C=C3C(=O)N4C5=CC=CC=C5N=C4S3
Cc1ccc(cc1)S(=O)(=O)Oc1cccc(c1)C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC23H16N2O4S2c11591118(121015)31(2728)291764516(1317)142122(26)2520832719(20)2423(25)3021h214H1H3b2114+
MFCD02108721
ZINC000009464759
ZINC09464759
ZINC9464759

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Available files

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