Vitas-M small molecule compound
N-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-2-{[3-(2H-tetrazol-2-yl)tricyclo[3.3.1.1~3,7~]dec-1-yl]acetyl}hydrazinecarbothioamide
Catalog ID
STK309577
SMILES CCn1ncc(c1C)NC(=S)NNC(=O)CC12CC3CC(C1)CC(C2)(C3)n1nncn1
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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 C20H29N9OS MW 443.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29N9OS/c1-3-28-13(2)16(10-22-28)24-18(31)26-25-17(30)9-19-5-14-4-15(6-19)8-20(7-14,11-19)29-23-12-21-27-29/h10,12,14-15H,3-9,11H2,1-2H3,(H,25,30)(H2,24,26,31)InChIKey
MVBZXXCFSCBXAC-UHFFFAOYSA-NSynonyms
1005677-84-81(1ETHYL5METHYLPYRAZOL4YL)3((2(3(TETRAZOL2YL)1ADAMANTYL)ACETYL)AMINO)THIOUREA
1005677848
CCN1C(=C(C=N1)NC(=S)NNC(=O)CC23CC4CC(C2)CC(C4)(C3)N5N=CN=N5)C
InChI=1SC20H29N9OSc132813(2)16(102228)2418(31)262517(30)919514415(619)820(7141119)292312212729h10121415H3911H212H3(H2530)(H2242631)
MFCD04053055
N(1ethyl5methyl1Hpyrazol4yl)2((3(2Htetrazol2yl)tricyclo(3311~37~)dec1yl)acetyl)hydrazinecarbothioamide
ZINC000013960008
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