Vitas-M small molecule compound
1-(morpholin-4-yl)-3-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Catalog ID
STK556178
SMILES N#Cc1c(SCC(=O)c2ccc(cc2)[N+](=O)[O-])nc(c2c1CCCC2)N1CCOCC1
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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 C22H22N4O4S MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O4S/c23-13-19-17-3-1-2-4-18(17)21(25-9-11-30-12-10-25)24-22(19)31-14-20(27)15-5-7-16(8-6-15)26(28)29/h5-8H,1-4,9-12,14H2InChIKey
DGSUCCHEODDMHG-UHFFFAOYSA-NSynonyms
672918-16-01(morpholin4yl)3((2(4nitrophenyl)2oxoethyl)sulfanyl)5678tetrahydroisoquinoline4carbonitrile
1morpholin4yl3(2(4nitrophenyl)2oxoethyl)sulfanyl5678tetrahydroisoquinoline4carbonitrile
1morpholino3((2(4nitrophenyl)2oxoethyl)thio)5678tetrahydroisoquinoline4carbonitrile
672918160
C1CCC2=C(N=C(C(=C2C1)C#N)SCC(=O)C3=CC=C(C=C3)(N+)(=O)(O))N4CCOCC4
InChI=1SC22H22N4O4Sc23131917312418(17)21(2591130121025)2422(19)311420(27)155716(8615)26(28)29h58H1491214H2
MFCD04016221
N#Cc1c(SCC(=O)c2ccc(cc2)(N+)(=O)(O))nc(c2c1CCCC2)N1CCOCC1
ZINC000020290452
ZINC20290452
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