Vitas-M small molecule compound
N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-3-methyl-4-nitrobenzamide
Catalog ID
STK066215
SMILES O=C(c1ccc(c(c1)C)[N+](=O)[O-])Nc1ccc(c(c1)c1nc2c(s1)cccc2)Cl
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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 C21H14ClN3O3S MW 423.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClN3O3S/c1-12-10-13(6-9-18(12)25(27)28)20(26)23-14-7-8-16(22)15(11-14)21-24-17-4-2-3-5-19(17)29-21/h2-11H,1H3,(H,23,26)InChIKey
YTXZBZAJLYSILR-UHFFFAOYSA-NSynonyms
CC1=C(C=CC(=C1)C(=O)NC2=CC(=C(C=C2)Cl)C3=NC4=CC=CC=C4S3)(N+)(=O)(O)
InChI=1SC21H14ClN3O3Sc1121013(6918(12)25(27)28)20(26)23147816(22)15(1114)212417423519(17)2921h211H1H3(H2326)
MFCD01928728
N(3(13BENZOTHIAZOL2YL)4CHLOROPHENYL)3METHYL4NITROBENZAMIDE
N(3(13BENZOTHIAZOL2YL)4CHLOROPHENYL)4NITRO3METHYLBENZAMIDE
O=C(c1ccc(c(c1)C)(N+)(=O)(O))Nc1ccc(c(c1)c1nc2c(s1)cccc2)Cl
STK066215
ZINC000002056942
ZINC02056942
ZINC2056942
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