Vitas-M small molecule compound
N-[3-(1,3-benzothiazol-2-yl)phenyl]-4-ethoxy-3-nitrobenzamide
Catalog ID
STK060479
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)Nc1cccc(c1)c1nc2c(s1)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 C22H17N3O4S MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O4S/c1-2-29-19-11-10-14(13-18(19)25(27)28)21(26)23-16-7-5-6-15(12-16)22-24-17-8-3-4-9-20(17)30-22/h3-13H,2H2,1H3,(H,23,26)InChIKey
PTSBVAHRBOZMFT-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)Nc1cccc(c1)c1nc2c(s1)cccc2
InChI=1SC22H17N3O4Sc122919111014(1318(19)25(27)28)21(26)231675615(1216)222417834920(17)3022h313H2H21H3(H2326)
MFCD01144847
N(3(13BENZOTHIAZOL2YL)PHENYL)4ETHOXY3NITROBENZAMIDE
N(3BENZOTHIAZOL2YLPHENYL)4ETHOXY3NITROBENZAMIDE
STK060479
ZINC000000817487
ZINC00817487
ZINC817487
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