Vitas-M small molecule compound
4-[5-(3,4-dichlorophenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]phenyl 1,3-dimethyl-1H-pyrazole-5-carboxylate
Catalog ID
STL149300
SMILES O=C1N(c2ccc(c(c2)Cl)Cl)C(=O)C2C1C(c1ccc(cc1)OC(=O)c1cc(nn1C)C)N(O2)c1ccccc1
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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 C29H22Cl2N4O5 MW 577.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22Cl2N4O5/c1-16-14-23(33(2)32-16)29(38)39-20-11-8-17(9-12-20)25-24-26(40-35(25)18-6-4-3-5-7-18)28(37)34(27(24)36)19-10-13-21(30)22(31)15-19/h3-15,24-26H,1-2H3InChIKey
PCLIYQSQRUVLBO-UHFFFAOYSA-NSynonyms
(4(5(34dichlorophenyl)46dioxo2phenyl3a6adihydro3Hpyrrolo(34d)(12)oxazol3yl)phenyl)25dimethylpyrazole3carboxylate
4(5(34dichlorophenyl)46dioxo2phenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)phenyl13dimethyl1Hpyrazole5carboxylate
4(5(34dichlorophenyl)46dioxo2phenylhexahydro2Hpyrrolo(34d)isoxazol3yl)phenyl13dimethyl1Hpyrazole5carboxylate
CC1=NN(C(=C1)C(=O)OC2=CC=C(C=C2)C3C4C(C(=O)N(C4=O)C5=CC(=C(C=C5)Cl)Cl)ON3C6=CC=CC=C6)C
InChI=1SC29H22Cl2N4O5c1161423(33(2)3216)29(38)392011817(91220)252426(4035(25)186435718)28(37)34(27(24)36)19101321(30)22(31)1519h3152426H12H3
MFCD20755574
ZINC000102928771
ZINC000106805905
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