Vitas-M small molecule compound
4-{2-[(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)amino]ethyl}-N-methylpiperazine-1-carbothioamide
Catalog ID
STK129856
SMILES CNC(=S)N1CCN(CC1)CCNC1=CC(=O)CC(C1)(C)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 C16H28N4OS MW 324.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H28N4OS/c1-16(2)11-13(10-14(21)12-16)18-4-5-19-6-8-20(9-7-19)15(22)17-3/h10,18H,4-9,11-12H2,1-3H3,(H,17,22)InChIKey
RSODLBOCPBKSNW-UHFFFAOYSA-NSynonyms
4(2((55DIMETHYL3OXO1CYCLOHEXEN1YL)AMINO)ETHYL)NMETHYL1PIPERAZINECARBOTHIOAMIDE
4(2((55DIMETHYL3OXOCYCLOHEX1EN1YL)AMINO)ETHYL)NMETHYLPIPERAZINE1CARBOTHIOAMIDE
4(2((55DIMETHYL3OXOCYCLOHEXEN1YL)AMINO)ETHYL)NMETHYLPIPERAZINE1CARBOTHIOAMIDE
CC1(CC(=CC(=O)C1)NCCN2CCN(CC2)C(=S)NC)C
InChI=1SC16H28N4OSc116(2)1113(1014(21)1216)1845196820(9719)15(22)173h1018H491112H213H3(H1722)
MFCD04060322
ZINC000096100761
ZINC96100761
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