Vitas-M small molecule compound

(3Z)-3-{[(4-chloro-2-methoxy-5-methylphenyl)amino]methylidene}-1-(4-fluorobenzyl)-1H-thieno[3,2-c][1,2]thiazin-4(3H)-one 2,2-dioxide

Catalog ID
STL081887
SMILES COc1cc(Cl)c(cc1N/C=C\1/C(=O)c2sccc2N(S1(=O)=O)Cc1ccc(cc1)F)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 C22H18ClFN2O4S2 MW 492.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClFN2O4S2/c1-13-9-17(19(30-2)10-16(13)23)25-11-20-21(27)22-18(7-8-31-22)26(32(20,28)29)12-14-3-5-15(24)6-4-14/h3-11,25H,12H2,1-2H3/b20-11-
InChIKey
AEVGRQHHFZNZCB-JAIQZWGSSA-N
Synonyms
894684-40-3
(3Z)3(((4chloro2methoxy5methylphenyl)amino)methylidene)1(4fluorobenzyl)1Hthieno(32c)(12)thiazin4(3H)one22dioxide
(3Z)3((4chloro2methoxy5methylanilino)methylidene)1((4fluorophenyl)methyl)22dioxothieno(32c)thiazin4one
894684403
CC1=CC(=C(C=C1Cl)OC)NC=C2C(=O)C3=C(C=CS3)N(S2(=O)=O)CC4=CC=C(C=C4)F
COc1cc(Cl)c(cc1NC=C1C(=O)c2sccc2N(S1(=O)=O)Cc1ccc(cc1)F)C
InChI=1SC22H18ClFN2O4S2c113917(19(302)1016(13)23)25112021(27)2218(783122)26(32(2028)29)12143515(24)6414h31125H12H212H3b2011
MFCD14930900
ZINC000020575834
ZINC20575834

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Available files

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