Vitas-M small molecule compound
2-[4-(2,4-dichlorophenyl)-2,5-dioxo-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carbonitrile
Catalog ID
STK779490
SMILES N#Cc1c(sc2c1CCCCCC2)N1C(=O)CC(C2=C1CCCC2=O)c1ccc(cc1Cl)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 C26H24Cl2N2O2S MW 499.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24Cl2N2O2S/c27-15-10-11-16(20(28)12-15)18-13-24(32)30(21-7-5-8-22(31)25(18)21)26-19(14-29)17-6-3-1-2-4-9-23(17)33-26/h10-12,18H,1-9,13H2InChIKey
XQPYNKWVTNMMDE-UHFFFAOYSA-NSynonyms
2(4(24dichlorophenyl)25dioxo345678hexahydroquinolin1(2H)yl)456789hexahydrocycloocta(b)thiophene3carbonitrile
2(4(24dichlorophenyl)25dioxo4678tetrahydro3Hquinolin1yl)456789hexahydrocycloocta(b)thiophene3carbonitrile
C1CCCC2=C(CC1)C(=C(S2)N3C4=C(C(CC3=O)C5=C(C=C(C=C5)Cl)Cl)C(=O)CCC4)C#N
InChI=1SC26H24Cl2N2O2Sc2715101116(20(28)1215)181324(32)30(2175822(31)25(18)21)2619(1429)1763124923(17)3326h101218H1913H2
MFCD05858608
ZINC000012428490
ZINC000012428491
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