Vitas-M small molecule compound
4-methoxy-N-{[2-(4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-3-nitrobenzamide
Catalog ID
STK180603
SMILES COc1ccc(cc1)c1oc2c(n1)cc(cc2)NC(=S)NC(=O)c1ccc(c(c1)[N+](=O)[O-])OC
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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 C23H18N4O6S MW 478.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4O6S/c1-31-16-7-3-13(4-8-16)22-25-17-12-15(6-10-19(17)33-22)24-23(34)26-21(28)14-5-9-20(32-2)18(11-14)27(29)30/h3-12H,1-2H3,(H2,24,26,28,34)InChIKey
SRWPHWGFIRUEIF-UHFFFAOYSA-NSynonyms
4METHOXYN((2(4METHOXYPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)3NITROBENZAMIDE
COC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC(=C(C=C4)OC)(N+)(=O)(O)
COc1ccc(cc1)c1oc2c(n1)cc(cc2)NC(=S)NC(=O)c1ccc(c(c1)(N+)(=O)(O))OC
InChI=1SC23H18N4O6Sc131167313(4816)2225171215(61019(17)3322)2423(34)2621(28)145920(322)18(1114)27(29)30h312H12H3(H224262834)
MFCD02810825
ZINC000003770759
ZINC03770759
ZINC3770759
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