Vitas-M small molecule compound
2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
Catalog ID
STL323868
SMILES N#Cc1cc2CCCc2nc1SCC(=O)c1ccc(cc1)C
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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 C18H16N2OS MW 308.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2OS/c1-12-5-7-13(8-6-12)17(21)11-22-18-15(10-19)9-14-3-2-4-16(14)20-18/h5-9H,2-4,11H2,1H3InChIKey
KNQDTFWAAPCSHD-UHFFFAOYSA-NSynonyms
316358-91-52((2(4methylphenyl)2oxoethyl)sulfanyl)67dihydro5Hcyclopenta(b)pyridine3carbonitrile
2((2oxo2(ptolyl)ethyl)thio)67dihydro5Hcyclopenta(b)pyridine3carbonitrile
2(2(4METHYLPHENYL)2OXOETHYL)SULFANYL67DIHYDRO5HCYCLOPENTA(B)PYRIDINE3CARBONITRILE
316358915
CC1=CC=C(C=C1)C(=O)CSC2=NC3=C(CCC3)C=C2C#N
InChI=1SC18H16N2OSc1125713(8612)17(21)11221815(1019)91432416(14)2018h59H2411H21H3
MFCD00487198
ZINC000000495690
ZINC00495690
ZINC495690
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