Vitas-M small molecule compound
4-(diphenylmethyl)-N-(2-methoxy-4-nitrophenyl)piperazine-1-carbothioamide
Catalog ID
STK455420
SMILES COc1cc(ccc1NC(=S)N1CCN(CC1)C(c1ccccc1)c1ccccc1)[N+](=O)[O-]
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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 C25H26N4O3S MW 462.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O3S/c1-32-23-18-21(29(30)31)12-13-22(23)26-25(33)28-16-14-27(15-17-28)24(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-13,18,24H,14-17H2,1H3,(H,26,33)InChIKey
ILBKASIZJHYHQN-UHFFFAOYSA-NSynonyms
(4(DIPHENYLMETHYL)PIPERAZINYL)((2METHOXY4NITROPHENYL)AMINO)METHANE1THIONE
4(diphenylmethyl)N(2methoxy4nitrophenyl)piperazine1carbothioamide
4BENZHYDRYLN(2METHOXY4NITROPHENYL)PIPERAZINE1CARBOTHIOAMIDE
COC1=C(C=CC(=C1)(N+)(=O)(O))NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4
COc1cc(ccc1NC(=S)N1CCN(CC1)C(c1ccccc1)c1ccccc1)(N+)(=O)(O)
InChI=1SC25H26N4O3Sc132231821(29(30)31)121322(23)2625(33)28161427(151728)24(198425919)20106371120h2131824H1417H21H3(H2633)
MFCD04227661
ZINC000016360969
ZINC16360969
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