Vitas-M small molecule compound
2-[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]-N-methylhydrazinecarbothioamide
Catalog ID
STK531480
SMILES CNC(=S)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCCC3
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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 C26H29N5O2S MW 475.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N5O2S/c1-27-25(34)30-29-24-28-22-20-9-5-4-8-17(20)16-26(14-6-3-7-15-26)21(22)23(32)31(24)18-10-12-19(33-2)13-11-18/h4-5,8-13H,3,6-7,14-16H2,1-2H3,(H,28,29)(H2,27,30,34)InChIKey
QKVUKJCYERRQQO-UHFFFAOYSA-NSynonyms
1((3(4METHOXYPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)AMINO)3METHYLTHIOUREA
2(3(4methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)Nmethylhydrazinecarbothioamide
CNC(=S)NNC1=NC2=C(C(=O)N1C3=CC=C(C=C3)OC)C4(CCCCC4)CC5=CC=CC=C52
InChI=1SC26H29N5O2Sc12725(34)302924282220954817(20)1626(146371526)21(22)23(32)31(24)18101219(332)131118h45813H3671416H212H3(H2829)(H2273034)
MFCD02233853
ZINC000001306884
ZINC01306884
ZINC1306884
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