Vitas-M small molecule compound
(7E)-2-[(4-chlorobenzyl)sulfanyl]-4-(thiophen-2-yl)-7-(thiophen-2-ylmethylidene)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Catalog ID
STK763788
SMILES N#Cc1c(SCc2ccc(cc2)Cl)nc2c(c1c1cccs1)CC/C/2=C\c1cccs1
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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 C25H17ClN2S3 MW 477.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17ClN2S3/c26-18-8-5-16(6-9-18)15-31-25-21(14-27)23(22-4-2-12-30-22)20-10-7-17(24(20)28-25)13-19-3-1-11-29-19/h1-6,8-9,11-13H,7,10,15H2/b17-13+InChIKey
JFOCPCZFFSUESH-GHRIWEEISA-NSynonyms
(7E)2((4chlorobenzyl)sulfanyl)4(thiophen2yl)7(thiophen2ylmethylidene)67dihydro5Hcyclopenta(b)pyridine3carbonitrile
(7E)2((4CHLOROPHENYL)METHYLSULFANYL)4THIOPHEN2YL7(THIOPHEN2YLMETHYLIDENE)56DIHYDROCYCLOPENTA(B)PYRIDINE3CARBONITRILE
C1CC2=C(C1=CC3=CC=CS3)N=C(C(=C2C4=CC=CS4)C#N)SCC5=CC=C(C=C5)Cl
InChI=1SC25H17ClN2S3c26188516(6918)15312521(1427)23(2242123022)2010717(24(20)2825)131931112919h16891113H71015H2b1713+
MFCD02647582
N#Cc1c(SCc2ccc(cc2)Cl)nc2c(c1c1cccs1)CCC2=Cc1cccs1
ZINC000008855094
ZINC08855094
ZINC8855094
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