Vitas-M small molecule compound
2-[(3-chlorobenzyl)sulfanyl]-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
Catalog ID
STK546547
SMILES N#Cc1cc2CCCCCc2nc1SCc1cccc(c1)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 C18H17ClN2S MW 328.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClN2S/c19-16-7-4-5-13(9-16)12-22-18-15(11-20)10-14-6-2-1-3-8-17(14)21-18/h4-5,7,9-10H,1-3,6,8,12H2InChIKey
PCMKUYBVBRABFX-UHFFFAOYSA-NSynonyms
445384-15-62((3chlorobenzyl)sulfanyl)6789tetrahydro5Hcyclohepta(b)pyridine3carbonitrile
2((3chlorobenzyl)thio)6789tetrahydro5Hcyclohepta(b)pyridine3carbonitrile
2((3chlorophenyl)methylsulfanyl)6789tetrahydro5Hcyclohepta(b)pyridine3carbonitrile
445384156
C1CCC2=C(CC1)N=C(C(=C2)C#N)SCC3=CC(=CC=C3)Cl
InChI=1SC18H17ClN2Sc191674513(916)12221815(1120)10146213817(14)2118h457910H136812H2
MFCD03234638
ZINC000017440244
ZINC17440244
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