Vitas-M small molecule compound
N-benzyl-2-[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]hydrazinecarbothioamide
Catalog ID
STK531285
SMILES S=C(NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3)NCc1ccccc1
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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 C32H33N5OS MW 535.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33N5OS/c1-22-14-16-25(17-15-22)37-29(38)27-28(26-13-7-6-12-24(26)20-32(27)18-8-3-9-19-32)34-30(37)35-36-31(39)33-21-23-10-4-2-5-11-23/h2,4-7,10-17H,3,8-9,18-21H2,1H3,(H,34,35)(H2,33,36,39)InChIKey
KUAHRTABMFSLTH-UHFFFAOYSA-NSynonyms
1BENZYL3((3(4METHYLPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)AMINO)THIOUREA
CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2NNC(=S)NCC6=CC=CC=C6
InChI=1SC32H33N5OSc122141625(171522)3729(38)2728(2613761224(26)2032(27)188391932)3430(37)353631(39)332123104251123h2471017H3891821H21H3(H3435)(H2333639)
MFCD02236963
Nbenzyl2(3(4methylphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)hydrazinecarbothioamide
Nbenzyl2(4oxo3(ptolyl)46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)hydrazinecarbothioamide
ZINC000002295412
ZINC2295412
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