Vitas-M small molecule compound
N-[4-(3,4-dimethylphenyl)-5-methyl-1,3-thiazol-2-yl]-3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamide
Catalog ID
STL403554
SMILES O=C(c1cccc(c1)Cn1ncc(c1)[N+](=O)[O-])Nc1sc(c(n1)c1ccc(c(c1)C)C)C
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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 C23H21N5O3S MW 447.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N5O3S/c1-14-7-8-18(9-15(14)2)21-16(3)32-23(25-21)26-22(29)19-6-4-5-17(10-19)12-27-13-20(11-24-27)28(30)31/h4-11,13H,12H2,1-3H3,(H,25,26,29)InChIKey
IECINEVTRMCBDS-UHFFFAOYSA-NSynonyms
512818-11-0512818110
CC1=C(C=C(C=C1)C2=C(SC(=N2)NC(=O)C3=CC(=CC=C3)CN4C=C(C=N4)(N+)(=O)(O))C)C
InChI=1SC23H21N5O3Sc1147818(915(14)2)2116(3)3223(2521)2622(29)1964517(1019)12271320(112427)28(30)31h41113H12H213H3(H252629)
MFCD03468258
N(4(34dimethylphenyl)5methyl13thiazol2yl)3((4nitro1Hpyrazol1yl)methyl)benzamide
N(4(34DIMETHYLPHENYL)5METHYL13THIAZOL2YL)3((4NITROPYRAZOL1YL)METHYL)BENZAMIDE
O=C(c1cccc(c1)Cn1ncc(c1)(N+)(=O)(O))Nc1sc(c(n1)c1ccc(c(c1)C)C)C
ZINC000002735304
ZINC02735304
ZINC2735304
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