Vitas-M small molecule compound

ethyl 2-{[(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino}-1,3-benzothiazole-6-carboxylate

Catalog ID
STK188454
SMILES CCOC(=O)c1ccc2c(c1)sc(n2)NC(=O)CSc1nc2c(o1)cccc2

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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 C19H15N3O4S2 MW 413.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O4S2/c1-2-25-17(24)11-7-8-13-15(9-11)28-18(20-13)22-16(23)10-27-19-21-12-5-3-4-6-14(12)26-19/h3-9H,2,10H2,1H3,(H,20,22,23)
InChIKey
HCFLQXIHBCMLHY-UHFFFAOYSA-N
Synonyms
314043-92-0
314043920
CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=NC4=CC=CC=C4O3
ETHYL2(((13BENZOXAZOL2YLSULFANYL)ACETYL)AMINO)13BENZOTHIAZOLE6CARBOXYLATE
ETHYL2((2(13BENZOXAZOL2YLSULFANYL)ACETYL)AMINO)13BENZOTHIAZOLE6CARBOXYLATE
InChI=1SC19H15N3O4S2c122517(24)11781315(911)2818(2013)2216(23)1027192112534614(12)2619h39H210H21H3(H202223)
MFCD01240708
ZINC000000714795
ZINC00714795
ZINC714795

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.