Vitas-M small molecule compound
4-({[3-(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-17-yl)phenyl]carbonyl}amino)benzoic acid (non-preferred name)
Catalog ID
STK270105
SMILES O=C1N(c2cccc(c2)C(=O)Nc2ccc(cc2)C(=O)O)C(=O)C2C1C1c3ccccc3C2c2c1cccc2
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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 C32H22N2O5 MW 514.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H22N2O5/c35-29(33-19-14-12-17(13-15-19)32(38)39)18-6-5-7-20(16-18)34-30(36)27-25-21-8-1-2-9-22(21)26(28(27)31(34)37)24-11-4-3-10-23(24)25/h1-16,25-28H,(H,33,35)(H,38,39)InChIKey
YZIKONMVXVQHMP-UHFFFAOYSA-NSynonyms
4(((3(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)phenyl)carbonyl)amino)benzoicacid(nonpreferredname)
C1=CC=C2C3C4C(C(C2=C1)C5=CC=CC=C35)C(=O)N(C4=O)C6=CC=CC(=C6)C(=O)NC7=CC=C(C=C7)C(=O)O
InChI=1SC32H22N2O5c3529(3319141217(131519)32(38)39)1865720(1618)3430(36)272521812922(21)26(28(27)31(34)37)2411431023(24)25h1162528H(H3335)(H3839)
MFCD01884647
ZINC000000991026
ZINC000000991029
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