Vitas-M small molecule compound
4-(2-{[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino}ethyl)-N-phenylpiperazine-1-carbothioamide
Catalog ID
STK741694
SMILES S=C(N1CCN(CC1)CCNC=C1C(=O)CC(CC1=O)(C)C)Nc1ccccc1
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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 C22H30N4O2S MW 414.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O2S/c1-22(2)14-19(27)18(20(28)15-22)16-23-8-9-25-10-12-26(13-11-25)21(29)24-17-6-4-3-5-7-17/h3-7,16,23H,8-15H2,1-2H3,(H,24,29)InChIKey
PNCRBYNKMIDLOQ-UHFFFAOYSA-NSynonyms
332144-75-9332144759
4(2(((44dimethyl26dioxocyclohexylidene)methyl)amino)ethyl)Nphenylpiperazine1carbothioamide
4(2((44DIMETHYL26DIOXOCYCLOHEXYLIDENE)METHYLAMINO)ETHYL)NPHENYLPIPERAZINE1CARBOTHIOAMIDE
4(2((44DIMETHYL26DIOXOCYCLOHEXYLIDENEMETHYL)AMINO)ETHYL)PIPERAZINE1CARBOTHIOICACIDPHENYLAMIDE
CC1(CC(=O)C(=CNCCN2CCN(CC2)C(=S)NC3=CC=CC=C3)C(=O)C1)C
InChI=1SC22H30N4O2Sc122(2)1419(27)18(20(28)1522)16238925101226(131125)21(29)24176435717h371623H815H212H3(H2429)
MFCD01210537
ZINC000100567660
ZINC100567660
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