Vitas-M small molecule compound
N-{4-[4-(butan-2-yl)phenyl]-1,3-thiazol-2-yl}-3-nitrobenzamide
Catalog ID
STK433807
SMILES CCC(c1ccc(cc1)c1csc(n1)NC(=O)c1cccc(c1)[N+](=O)[O-])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 C20H19N3O3S MW 381.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O3S/c1-3-13(2)14-7-9-15(10-8-14)18-12-27-20(21-18)22-19(24)16-5-4-6-17(11-16)23(25)26/h4-13H,3H2,1-2H3,(H,21,22,24)InChIKey
XFYKXVXXFZXCQS-UHFFFAOYSA-NSynonyms
CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
CCC(c1ccc(cc1)c1csc(n1)NC(=O)c1cccc(c1)(N+)(=O)(O))C
InChI=1SC20H19N3O3Sc1313(2)147915(10814)18122720(2118)2219(24)1654617(1116)23(25)26h413H3H212H3(H212224)
MFCD03388818
N(4(4(butan2yl)phenyl)13thiazol2yl)3nitrobenzamide
N(4(4(METHYLPROPYL)PHENYL)(13THIAZOL2YL))(3NITROPHENYL)CARBOXAMIDE
N(4(4BUTAN2YLPHENYL)13THIAZOL2YL)3NITROBENZAMIDE
N(4(4SECBUTYLPHENYL)13THIAZOL2YL)3NITROBENZAMIDE
ZINC000000670925
ZINC000000670927
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