Vitas-M small molecule compound
methyl 2-{[(6-chloro-3-methyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}benzoate
Catalog ID
STK603093
SMILES COC(=O)c1ccccc1NC(=O)C1(C)OC(=O)c2c(C1)cc(cc2)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 C19H16ClNO5 MW 373.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClNO5/c1-19(10-11-9-12(20)7-8-13(11)17(23)26-19)18(24)21-15-6-4-3-5-14(15)16(22)25-2/h3-9H,10H2,1-2H3,(H,21,24)InChIKey
PBNYLJRMJMUXEI-UHFFFAOYSA-NSynonyms
900899-67-4900899674
CC1(CC2=C(C=CC(=C2)Cl)C(=O)O1)C(=O)NC3=CC=CC=C3C(=O)OC
InChI=1SC19H16ClNO5c119(1011912(20)7813(11)17(23)2619)18(24)2115643514(15)16(22)252h39H10H212H3(H2124)
methyl2(((6chloro3methyl1oxo34dihydro1Hisochromen3yl)carbonyl)amino)benzoate
METHYL2((6CHLORO3METHYL1OXO4HISOCHROMENE3CARBONYL)AMINO)BENZOATE
methyl2(6chloro3methyl1oxoisochroman3carboxamido)benzoate
MFCD06778674
ZINC000009488054
ZINC000009488055
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