Vitas-M small molecule compound
(2E)-3-{5-[(4-chloro-2-nitrophenoxy)methyl]furan-2-yl}-1-(1-methyl-1H-pyrazol-5-yl)prop-2-en-1-one
Catalog ID
STL397257
SMILES Clc1ccc(c(c1)[N+](=O)[O-])OCc1ccc(o1)/C=C/C(=O)c1ccnn1C
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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 C18H14ClN3O5 MW 387.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14ClN3O5/c1-21-15(8-9-20-21)17(23)6-5-13-3-4-14(27-13)11-26-18-7-2-12(19)10-16(18)22(24)25/h2-10H,11H2,1H3/b6-5+InChIKey
SJOJTIBJUSOISZ-AATRIKPKSA-NSynonyms
1005635-70-0(2E)3(5((4CHLORO2NITROPHENOXY)METHYL)FURAN2YL)1(1METHYL1HPYRAZOL5YL)PROP2EN1ONE
(E)3(5((4CHLORO2NITROPHENOXY)METHYL)FURAN2YL)1(2METHYLPYRAZOL3YL)PROP2EN1ONE
1005635700
Clc1ccc(c(c1)(N+)(=O)(O))OCc1ccc(o1)C=CC(=O)c1ccnn1C
CN1C(=CC=N1)C(=O)C=CC2=CC=C(O2)COC3=C(C=C(C=C3)Cl)(N+)(=O)(O)
InChI=1SC18H14ClN3O5c12115(892021)17(23)65133414(2713)1126187212(19)1016(18)22(24)25h210H11H21H3b65+
MFCD04053358
ZINC000006827510
ZINC06827510
ZINC6827510
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