Vitas-M small molecule compound
N-{2-[(2-methoxy-5-nitrobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}-3-methylbenzamide
Catalog ID
STK760676
SMILES COc1ccc(cc1CSc1sc2c(n1)ccc(c2)NC(=O)c1cccc(c1)C)[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 C23H19N3O4S2 MW 465.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O4S2/c1-14-4-3-5-15(10-14)22(27)24-17-6-8-19-21(12-17)32-23(25-19)31-13-16-11-18(26(28)29)7-9-20(16)30-2/h3-12H,13H2,1-2H3,(H,24,27)InChIKey
BXZUGBSKXHNRDA-UHFFFAOYSA-NSynonyms
CC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=C(C=CC(=C4)(N+)(=O)(O))OC
COc1ccc(cc1CSc1sc2c(n1)ccc(c2)NC(=O)c1cccc(c1)C)(N+)(=O)(O)
InChI=1SC23H19N3O4S2c11443515(1014)22(27)2417681921(1217)3223(2519)3113161118(26(28)29)7920(16)302h312H13H212H3(H2427)
MFCD01626384
N(2((2methoxy5nitrobenzyl)sulfanyl)13benzothiazol6yl)3methylbenzamide
N(2((2METHOXY5NITROPHENYL)METHYLSULFANYL)13BENZOTHIAZOL6YL)3METHYLBENZAMIDE
ZINC000003669344
ZINC03669344
ZINC3669344
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