Vitas-M small molecule compound
4-{2-[(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)amino]ethyl}-N-phenylpiperazine-1-carbothioamide
Catalog ID
STK082470
SMILES O=C1C=C(NCCN2CCN(CC2)C(=S)Nc2ccccc2)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 C21H30N4OS MW 386.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N4OS/c1-21(2)15-18(14-19(26)16-21)22-8-9-24-10-12-25(13-11-24)20(27)23-17-6-4-3-5-7-17/h3-7,14,22H,8-13,15-16H2,1-2H3,(H,23,27)InChIKey
WDHZHGAYFKXLSW-UHFFFAOYSA-NSynonyms
330645-71-1330645711
4(2((55DIMETHYL3OXOCYCLOHEX1EN1YL)AMINO)ETHYL)NPHENYLPIPERAZINE1CARBOTHIOAMIDE
4(2((55DIMETHYL3OXOCYCLOHEXEN1YL)AMINO)ETHYL)NPHENYLPIPERAZINE1CARBOTHIOAMIDE
4(2(55DIMETHYL3OXOCYCLOHEX1ENYLAMINO)ETHYL)PIPERAZINE1CARBOTHIOICACIDPHENYLAMIDE
55DIMETHYL3((2(4((PHENYLAMINO)THIOXOMETHYL)PIPERAZINYL)ETHYL)AMINO)CYCLOHEX2EN1ONE
CC1(CC(=CC(=O)C1)NCCN2CCN(CC2)C(=S)NC3=CC=CC=C3)C
InChI=1SC21H30N4OSc121(2)1518(1419(26)1621)228924101225(131124)20(27)23176435717h371422H8131516H212H3(H2327)
MFCD01856310
STK082470
ZINC000095482945
ZINC95482945
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