Vitas-M small molecule compound

4-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(1,1-dioxido-1,2-thiazinan-2-yl)benzamide

Catalog ID
STK645311
SMILES COc1cc(CCNC(=O)c2ccc(c(c2)N2CCCCS2(=O)=O)Cl)ccc1OC

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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 C21H25ClN2O5S MW 452.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN2O5S/c1-28-19-8-5-15(13-20(19)29-2)9-10-23-21(25)16-6-7-17(22)18(14-16)24-11-3-4-12-30(24,26)27/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,23,25)
InChIKey
BNTBZQNDOCXQNQ-UHFFFAOYSA-N
Synonyms
1011959-33-3
1011959333
4chloroN(2(34dimethoxyphenyl)ethyl)3(11dioxido12thiazinan2yl)benzamide
4chloroN(2(34dimethoxyphenyl)ethyl)3(11dioxothiazinan2yl)benzamide
4chloroN(34dimethoxyphenethyl)3(11dioxido12thiazinan2yl)benzamide
COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=C(C=C2)Cl)N3CCCCS3(=O)=O)OC
InChI=1SC21H25ClN2O5Sc128198515(1320(19)292)9102321(25)166717(22)18(1416)2411341230(2426)27h581314H34912H212H3(H2325)
MFCD08007406
ZINC000012194962
ZINC12194962

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Available files

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