Vitas-M small molecule compound
ethyl 4-[({[6-(propanoylamino)-1,3-benzothiazol-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK129836
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1sc2c(n1)ccc(c2)NC(=O)CC
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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 C21H21N3O4S2 MW 443.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4S2/c1-3-18(25)23-15-9-10-16-17(11-15)30-21(24-16)29-12-19(26)22-14-7-5-13(6-8-14)20(27)28-4-2/h5-11H,3-4,12H2,1-2H3,(H,22,26)(H,23,25)InChIKey
MLKFPIFWCJWJNO-UHFFFAOYSA-NSynonyms
CCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)NC3=CC=C(C=C3)C(=O)OCC
ETHYL4((((6(PROPANOYLAMINO)13BENZOTHIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4((2((6(PROPANOYLAMINO)13BENZOTHIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC21H21N3O4S2c1318(25)23159101617(1115)3021(2416)291219(26)22147513(6814)20(27)2842h511H3412H212H3(H2226)(H2325)
MFCD03870079
ZINC000009849821
ZINC09849821
ZINC9849821
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