Vitas-M small molecule compound
2-(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 2,4-dichlorobenzoate (non-preferred name)
Catalog ID
STK268876
SMILES Clc1ccc(c(c1)Cl)C(=O)Oc1ccccc1N1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3
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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 C31H19Cl2NO4 MW 540.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H19Cl2NO4/c32-16-13-14-21(22(33)15-16)31(37)38-24-12-6-5-11-23(24)34-29(35)27-25-17-7-1-2-8-18(17)26(28(27)30(34)36)20-10-4-3-9-19(20)25/h1-15,25-28HInChIKey
CDPJLOGKPLULFC-UHFFFAOYSA-NSynonyms
2(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)phenyl24dichlorobenzoate(nonpreferredname)
C1=CC=C2C3C4C(C(C2=C1)C5=CC=CC=C35)C(=O)N(C4=O)C6=CC=CC=C6OC(=O)C7=C(C=C(C=C7)Cl)Cl
InChI=1SC31H19Cl2NO4c3216131421(22(33)1516)31(37)382412651123(24)3429(35)272517712818(17)26(28(27)30(34)36)201043919(20)25h1152528H
MFCD01363122
ZINC000002078137
ZINC000002078140
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