Vitas-M small molecule compound

4-chloro-N-[(2E)-5-cyclopropyl-1,3,4-thiadiazol-2(3H)-ylidene]-3-(1,1-dioxido-1,2-thiazinan-2-yl)benzamide

Catalog ID
STL157071
SMILES O=C(c1ccc(c(c1)N1CCCCS1(=O)=O)Cl)/N=c/1\[nH]nc(s1)C1CC1

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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 C16H17ClN4O3S2 MW 412.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN4O3S2/c17-12-6-5-11(9-13(12)21-7-1-2-8-26(21,23)24)14(22)18-16-20-19-15(25-16)10-3-4-10/h5-6,9-10H,1-4,7-8H2,(H,18,20,22)
InChIKey
ORTFLJBQHULGAD-UHFFFAOYSA-N
Synonyms
1310946-92-9
1310946929
4chloroN((2E)5cyclopropyl134thiadiazol2(3H)ylidene)3(11dioxido12thiazinan2yl)benzamide
4chloroN(5cyclopropyl134thiadiazol2yl)3(11dioxothiazinan2yl)benzamide
C1CCS(=O)(=O)N(C1)C2=C(C=CC(=C2)C(=O)NC3=NN=C(S3)C4CC4)Cl
InChI=1SC16H17ClN4O3S2c17126511(913(12)21712826(2123)24)14(22)1816201915(2516)103410h56910H1478H2(H182022)
MFCD20757877
O=C(c1ccc(c(c1)N1CCCCS1(=O)=O)Cl)N=c1(nH)nc(s1)C1CC1
ZINC000071280256
ZINC71280256

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Available files

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