Vitas-M small molecule compound
methyl 4-{[(1Z)-2-(5-chloro-1,3-benzoxazol-2-yl)-3-oxoprop-1-en-1-yl]amino}benzoate
Catalog ID
STL170857
SMILES O=C/C(=C\Nc1ccc(cc1)C(=O)OC)/c1nc2c(o1)ccc(c2)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 C18H13ClN2O4 MW 356.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClN2O4/c1-24-18(23)11-2-5-14(6-3-11)20-9-12(10-22)17-21-15-8-13(19)4-7-16(15)25-17/h2-10,20H,1H3/b12-9+InChIKey
XMPLRXNJDQMCBH-FMIVXFBMSA-NSynonyms
COC(=O)C1=CC=C(C=C1)NC=C(C=O)C2=NC3=C(O2)C=CC(=C3)Cl
InChI=1SC18H13ClN2O4c12418(23)112514(6311)20912(1022)172115813(19)4716(15)2517h21020H1H3b129+
methyl4(((1Z)2(5chloro13benzoxazol2yl)3oxoprop1en1yl)amino)benzoate
METHYL4(((Z)2(5CHLORO13BENZOXAZOL2YL)3OXOPROP1ENYL)AMINO)BENZOATE
METHYL4((2(5CHLORO13BENZOXAZOL2YL)3OXO1PROPENYL)AMINO)BENZOATE
MFCD01178717
O=CC(=CNc1ccc(cc1)C(=O)OC)c1nc2c(o1)ccc(c2)Cl
ZINC000002741272
ZINC02741272
ZINC2741272
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