Vitas-M small molecule compound
N-{[2-methyl-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-4-nitrobenzamide
Catalog ID
STK059159
SMILES S=C(NC(=O)c1ccc(cc1)[N+](=O)[O-])Nc1cc(ccc1C)c1nc2c(o1)ccc(c2)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 C23H18N4O4S MW 446.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O4S/c1-13-3-10-20-19(11-13)24-22(31-20)16-5-4-14(2)18(12-16)25-23(32)26-21(28)15-6-8-17(9-7-15)27(29)30/h3-12H,1-2H3,(H2,25,26,28,32)InChIKey
LCPLIDXTCNLEKP-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)C)NC(=S)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC23H18N4O4Sc1133102019(1113)2422(3120)165414(2)18(1216)2523(32)2621(28)156817(9715)27(29)30h312H12H3(H225262832)
MFCD02624983
N((2METHYL5(5METHYL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)4NITROBENZAMIDE
S=C(NC(=O)c1ccc(cc1)(N+)(=O)(O))Nc1cc(ccc1C)c1nc2c(o1)ccc(c2)C
STK059159
ZINC000001176606
ZINC01176606
ZINC1176606
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