Vitas-M small molecule compound
4-ethoxy-N-{[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-3-nitrobenzamide
Catalog ID
STK173902
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1cccc(c1)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 C24H20N4O5S MW 476.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4O5S/c1-3-32-21-10-8-15(13-19(21)28(30)31)22(29)27-24(34)25-17-6-4-5-16(12-17)23-26-18-11-14(2)7-9-20(18)33-23/h4-13H,3H2,1-2H3,(H2,25,27,29,34)InChIKey
ZKWMIORMFVBLMO-UHFFFAOYSA-NSynonyms
4ETHOXYN((3(5METHYL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)3NITROBENZAMIDE
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C3=NC4=C(O3)C=CC(=C4)C)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1cccc(c1)c1nc2c(o1)ccc(c2)C
InChI=1SC24H20N4O5Sc13322110815(1319(21)28(30)31)22(29)2724(34)251764516(1217)2326181114(2)7920(18)3323h413H3H212H3(H225272934)
MFCD02820662
ZINC000002985011
ZINC02985011
ZINC2985011
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