Vitas-M small molecule compound
2-[(3-oxocyclohex-1-en-1-yl)amino]-4,5,6,7,8,8a-hexahydro-3aH-cyclohepta[b]thiophene-3-carbonitrile
Catalog ID
STK779512
SMILES N#CC1=C(NC2=CC(=O)CCC2)SC2C1CCCCC2
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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 C16H20N2OS MW 288.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2OS/c17-10-14-13-7-2-1-3-8-15(13)20-16(14)18-11-5-4-6-12(19)9-11/h9,13,15,18H,1-8H2InChIKey
RSHLGBJZAINWFA-UHFFFAOYSA-NSynonyms
2((3oxocyclohex1en1yl)amino)456788ahexahydro3aHcyclohepta(b)thiophene3carbonitrile
2((3oxocyclohexen1yl)amino)456788ahexahydro3aHcyclohepta(b)thiophene3carbonitrile
9((3OXOCYCLOHEX1ENYL)AMINO)10THIABICYCLO(530)DEC8ENE8CARBONITRILE
C1CCC2C(CC1)SC(=C2C#N)NC3=CC(=O)CCC3
InChI=1SC16H20N2OSc171014137213815(13)2016(14)181154612(19)911h9131518H18H2
MFCD05858631
ZINC000008643142
ZINC000018006835
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