Vitas-M small molecule compound

2-[(2E)-2-benzylidenehydrazinyl]-3-(4-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one

Catalog ID
STL199708
SMILES Cc1ccc(cc1)n1c(N/N=C/c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1

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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 C31H30N4O MW 474.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O/c1-22-14-16-25(17-15-22)35-29(36)27-28(33-30(35)34-32-21-23-10-4-2-5-11-23)26-13-7-6-12-24(26)20-31(27)18-8-3-9-19-31/h2,4-7,10-17,21H,3,8-9,18-20H2,1H3,(H,33,34)/b32-21+
InChIKey
YXEFDDKJXMQTJF-RUMWWMSVSA-N
Synonyms
372153-81-6
(E)2(2benzylidenehydrazinyl)3(ptolyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((2E)2benzylidenehydrazinyl)3(4methylphenyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
2((2E)2benzylidenehydrazinyl)3(4methylphenyl)spiro(6Hbenzo(h)quinazoline51cyclohexane)4one
372153816
CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2NN=CC6=CC=CC=C6
Cc1ccc(cc1)n1c(NN=Cc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
InChI=1SC31H30N4Oc122141625(171522)3529(36)2728(3330(35)34322123104251123)2613761224(26)2031(27)188391931h247101721H3891820H21H3(H3334)b3221+
MFCD01878352
ZINC000013764452
ZINC97531486

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Available files

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