Vitas-M small molecule compound
2-[2-(4-chlorophenyl)-3-(furan-2-yl)-4,6-dioxohexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Catalog ID
STL020354
SMILES N#Cc1c(sc2c1CCCC2)N1C(=O)C2C(C1=O)C(N(O2)c1ccc(cc1)Cl)c1ccco1
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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 C24H18ClN3O4S MW 479.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClN3O4S/c25-13-7-9-14(10-8-13)28-20(17-5-3-11-31-17)19-21(32-28)23(30)27(22(19)29)24-16(12-26)15-4-1-2-6-18(15)33-24/h3,5,7-11,19-21H,1-2,4,6H2InChIKey
PEKOAXRGSBGSSR-UHFFFAOYSA-NSynonyms
1005046-75-21005046752
2(2(4chlorophenyl)3(furan2yl)46dioxo3a6adihydro3Hpyrrolo(34d)(12)oxazol5yl)4567tetrahydro1benzothiophene3carbonitrile
2(2(4chlorophenyl)3(furan2yl)46dioxohexahydro5Hpyrrolo(34d)(12)oxazol5yl)4567tetrahydro1benzothiophene3carbonitrile
C1CCC2=C(C1)C(=C(S2)N3C(=O)C4C(N(OC4C3=O)C5=CC=C(C=C5)Cl)C6=CC=CO6)C#N
InChI=1SC24H18ClN3O4Sc25137914(10813)2820(1753113117)1921(3228)23(30)27(22(19)29)2416(1226)15412618(15)3324h357111921H1246H2
MFCD02971171
ZINC000102863126
ZINC000238923650
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