Vitas-M small molecule compound
methyl (4Z)-4-(3-chlorobenzylidene)-1-(3-methoxypropyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK698673
SMILES COCCCN1C(=O)/C(=C\c2cccc(c2)Cl)/C(=C1C)C(=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 C18H20ClNO4 MW 349.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClNO4/c1-12-16(18(22)24-3)15(11-13-6-4-7-14(19)10-13)17(21)20(12)8-5-9-23-2/h4,6-7,10-11H,5,8-9H2,1-3H3/b15-11-InChIKey
OGVLNTQOJDNPDL-PTNGSMBKSA-NSynonyms
CC1=C(C(=CC2=CC(=CC=C2)Cl)C(=O)N1CCCOC)C(=O)OC
COCCCN1C(=O)C(=Cc2cccc(c2)Cl)C(=C1C)C(=O)OC
InChI=1SC18H20ClNO4c11216(18(22)243)15(111364714(19)1013)17(21)20(12)859232h4671011H589H213H3b1511
METHYL(4Z)4((3CHLOROPHENYL)METHYLIDENE)1(3METHOXYPROPYL)2METHYL5OXOPYRROLE3CARBOXYLATE
methyl(4Z)4(3chlorobenzylidene)1(3methoxypropyl)2methyl5oxo45dihydro1Hpyrrole3carboxylate
MFCD01572816
ZINC000002844981
ZINC02844981
ZINC2844981
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