Vitas-M small molecule compound
2,4-dichloro-N-{2-[(2-methoxy-5-nitrobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}benzamide
Catalog ID
STK675696
SMILES COc1ccc(cc1CSc1nc2c(s1)cc(cc2)NC(=O)c1ccc(cc1Cl)Cl)[N+](=O)[O-]
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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 C22H15Cl2N3O4S2 MW 520.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15Cl2N3O4S2/c1-31-19-7-4-15(27(29)30)8-12(19)11-32-22-26-18-6-3-14(10-20(18)33-22)25-21(28)16-5-2-13(23)9-17(16)24/h2-10H,11H2,1H3,(H,25,28)InChIKey
AMGCEZGMJXYYSL-UHFFFAOYSA-NSynonyms
24dichloroN(2((2methoxy5nitrobenzyl)sulfanyl)13benzothiazol6yl)benzamide
24DICHLORON(2((2METHOXY5NITROPHENYL)METHYLSULFANYL)13BENZOTHIAZOL6YL)BENZAMIDE
COC1=C(C=C(C=C1)(N+)(=O)(O))CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4=C(C=C(C=C4)Cl)Cl
COc1ccc(cc1CSc1nc2c(s1)cc(cc2)NC(=O)c1ccc(cc1Cl)Cl)(N+)(=O)(O)
InChI=1SC22H15Cl2N3O4S2c131197415(27(29)30)812(19)11322226186314(1020(18)3322)2521(28)165213(23)917(16)24h210H11H21H3(H2528)
MFCD01626387
ZINC000003669588
ZINC3669588
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