Vitas-M small molecule compound
4-{2-[(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)amino]ethyl}-N-(4-fluorophenyl)piperazine-1-carbothioamide
Catalog ID
STK091751
SMILES O=C1C=C(NCCN2CCN(CC2)C(=S)Nc2ccc(cc2)F)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 C21H29FN4OS MW 404.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29FN4OS/c1-21(2)14-18(13-19(27)15-21)23-7-8-25-9-11-26(12-10-25)20(28)24-17-5-3-16(22)4-6-17/h3-6,13,23H,7-12,14-15H2,1-2H3,(H,24,28)InChIKey
LOPQMYNIYAHLEF-UHFFFAOYSA-NSynonyms
510766-49-14(2((55DIMETHYL3OXOCYCLOHEX1EN1YL)AMINO)ETHYL)N(4FLUOROPHENYL)PIPERAZINE1CARBOTHIOAMIDE
4(2((55DIMETHYL3OXOCYCLOHEXEN1YL)AMINO)ETHYL)N(4FLUOROPHENYL)PIPERAZINE1CARBOTHIOAMIDE
4(2(55DIMETHYL3OXOCYCLOHEX1ENYLAMINO)ETHYL)N(4FLUOROPHENYL)PIPERAZINE1CARBOTHIOAMIDE
4(2(55DIMETHYL3OXOCYCLOHEX1ENYLAMINO)ETHYL)PIPERAZINE1CARBOTHIOICACID(4FLUOROPHENYL)AMIDE
510766491
CC1(CC(=CC(=O)C1)NCCN2CCN(CC2)C(=S)NC3=CC=C(C=C3)F)C
InChI=1SC21H29FN4OSc121(2)1418(1319(27)1521)23782591126(121025)20(28)24175316(22)4617h361323H7121415H212H3(H2428)
MFCD03194876
O=C1C=C(NCCN2CCN(CC2)C(=S)Nc2ccc(cc2)F)CC(C1)(C)C
STK091751
ZINC000095546358
ZINC95546358
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Check stock on Vitas-MAvailable files
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