Vitas-M small molecule compound
N-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]hexahydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide
Catalog ID
STK309833
SMILES S=C(N1CCN2C(C1)CCC2)Nc1c(C)nn(c1C)Cc1ccccc1C
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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 C21H29N5S MW 383.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N5S/c1-15-7-4-5-8-18(15)13-26-17(3)20(16(2)23-26)22-21(27)25-12-11-24-10-6-9-19(24)14-25/h4-5,7-8,19H,6,9-14H2,1-3H3,(H,22,27)InChIKey
ZCJCEKHGNDEKGZ-UHFFFAOYSA-NSynonyms
1005607-91-91005607919
CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=S)N3CCN4CCCC4C3)C
InChI=1SC21H29N5Sc115745818(15)132617(3)20(16(2)2326)2221(27)25121124106919(24)1425h457819H6914H213H3(H2227)
MFCD04134054
N(35dimethyl1((2methylphenyl)methyl)pyrazol4yl)346788ahexahydro1Hpyrrolo(12a)pyrazine2carbothioamide
N(35dimethyl1(2methylbenzyl)1Hpyrazol4yl)hexahydropyrrolo(12a)pyrazine2(1H)carbothioamide
ZINC000002803204
ZINC000002803205
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