Vitas-M small molecule compound
3-{[2-(2,4-dichlorophenyl)-2-oxoethyl]sulfanyl}-1-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Catalog ID
STK788552
SMILES N#Cc1c(SCC(=O)c2ccc(cc2Cl)Cl)nc(c2c1CCCC2)c1cc(OC)c(c(c1)OC)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 C27H24Cl2N2O4S MW 543.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24Cl2N2O4S/c1-33-23-10-15(11-24(34-2)26(23)35-3)25-18-7-5-4-6-17(18)20(13-30)27(31-25)36-14-22(32)19-9-8-16(28)12-21(19)29/h8-12H,4-7,14H2,1-3H3InChIKey
NVIRMKUZQNYDEX-UHFFFAOYSA-NSynonyms
3((2(24dichlorophenyl)2oxoethyl)sulfanyl)1(345trimethoxyphenyl)5678tetrahydroisoquinoline4carbonitrile
3((2(24dichlorophenyl)2oxoethyl)thio)1(345trimethoxyphenyl)5678tetrahydroisoquinoline4carbonitrile
3(2(24dichlorophenyl)2oxoethyl)sulfanyl1(345trimethoxyphenyl)5678tetrahydroisoquinoline4carbonitrile
COC1=CC(=CC(=C1OC)OC)C2=C3CCCCC3=C(C(=N2)SCC(=O)C4=C(C=C(C=C4)Cl)Cl)C#N
InChI=1SC27H24Cl2N2O4Sc133231015(1124(342)26(23)353)2518754617(18)20(1330)27(3125)361422(32)199816(28)1221(19)29h812H4714H213H3
MFCD02983382
ZINC000002303098
ZINC2303098
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