Vitas-M small molecule compound
N-{[2-(4-chlorobenzyl)-1,3-benzoxazol-5-yl]carbamothioyl}-4-methoxy-3-nitrobenzamide
Catalog ID
STK233843
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)Cc1ccc(cc1)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 C23H17ClN4O5S MW 496.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClN4O5S/c1-32-20-8-4-14(11-18(20)28(30)31)22(29)27-23(34)25-16-7-9-19-17(12-16)26-21(33-19)10-13-2-5-15(24)6-3-13/h2-9,11-12H,10H2,1H3,(H2,25,27,29,34)InChIKey
VNJJPQLXOJIWBQ-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)CC4=CC=C(C=C4)Cl)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)Cc1ccc(cc1)Cl
InChI=1SC23H17ClN4O5Sc132208414(1118(20)28(30)31)22(29)2723(34)2516791917(1216)2621(3319)10132515(24)6313h291112H10H21H3(H225272934)
MFCD02810846
N((2((4CHLOROPHENYL)METHYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)4METHOXY3NITROBENZAMIDE
N((2(4chlorobenzyl)13benzoxazol5yl)carbamothioyl)4methoxy3nitrobenzamide
ZINC000002978457
ZINC02978457
ZINC2978457
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