Vitas-M small molecule compound
N-(4-ethylphenyl)-2-[(2E)-2-{[17-(4-methylphenyl)-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-1-yl]methylidene}hydrazinyl]-2-oxoacetamide (non-preferred name)
Catalog ID
STK670733
SMILES CCc1ccc(cc1)NC(=O)C(=O)N/N=C/C12C3C(C(c4c1cccc4)c1c2cccc1)C(=O)N(C3=O)c1ccc(cc1)C
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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 C36H30N4O4 MW 582.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H30N4O4/c1-3-22-14-16-23(17-15-22)38-32(41)33(42)39-37-20-36-27-10-6-4-8-25(27)29(26-9-5-7-11-28(26)36)30-31(36)35(44)40(34(30)43)24-18-12-21(2)13-19-24/h4-20,29-31H,3H2,1-2H3,(H,38,41)(H,39,42)/b37-20+InChIKey
IQMSAXHIJRGFCU-HASSKWOGSA-NSynonyms
CCC1=CC=C(C=C1)NC(=O)C(=O)NN=CC23C4C(C(C5=CC=CC=C52)C6=CC=CC=C36)C(=O)N(C4=O)C7=CC=C(C=C7)C
CCc1ccc(cc1)NC(=O)C(=O)NN=CC12C3C(C(c4c1cccc4)c1c2cccc1)C(=O)N(C3=O)c1ccc(cc1)C
InChI=1SC36H30N4O4c1322141623(171522)3832(41)33(42)39372036271064825(27)29(269571128(26)36)3031(36)35(44)40(34(30)43)24181221(2)131924h4202931H3H212H3(H3841)(H3942)b3720+
MFCD00739460
N(4ethylphenyl)2((2E)2((17(4methylphenyl)1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen1yl)methylidene)hydrazinyl)2oxoacetamide(nonpreferredna
ZINC000098001463
ZINC000098001466
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