Vitas-M small molecule compound

N-(2-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamide

Catalog ID
STK841967
SMILES O=C(NCc1ccccc1)CSc1nc2c(s1)cc(cc2)NC(=O)CSc1nnnn1C

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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 C20H19N7O2S3 MW 485.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N7O2S3/c1-27-19(24-25-26-27)30-12-18(29)22-14-7-8-15-16(9-14)32-20(23-15)31-11-17(28)21-10-13-5-3-2-4-6-13/h2-9H,10-12H2,1H3,(H,21,28)(H,22,29)
InChIKey
XEPRTPFVNNZQKB-UHFFFAOYSA-N
Synonyms
433702-34-2
433702342
CN1C(=NN=N1)SCC(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NCC4=CC=CC=C4
InChI=1SC20H19N7O2S3c12719(24252627)301218(29)2214781516(914)3220(2315)311117(28)2110135324613h29H1012H21H3(H2128)(H2229)
MFCD03082311
N(2((2(benzylamino)2oxoethyl)sulfanyl)13benzothiazol6yl)2((1methyl1Htetrazol5yl)sulfanyl)acetamide
N(2(2(BENZYLAMINO)2OXOETHYL)SULFANYL13BENZOTHIAZOL6YL)2(1METHYLTETRAZOL5YL)SULFANYLACETAMIDE
Nbenzyl2((6(2((1methyl1Htetrazol5yl)thio)acetamido)benzo(d)thiazol2yl)thio)acetamide
ZINC000002162819
ZINC02162819
ZINC2162819

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Available files

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