Vitas-M small molecule compound
4-(3,4-dichlorophenyl)-1-(3,4-dimethylphenyl)-N-(2-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STL040995
SMILES COc1ccccc1NC(=O)c1c(c2ccc(c(c2)C)C)c2c3n1cc(n3CCCC2)c1ccc(c(c1)Cl)Cl
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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 C32H29Cl2N3O2 MW 558.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29Cl2N3O2/c1-19-11-12-22(16-20(19)2)29-23-8-6-7-15-36-27(21-13-14-24(33)25(34)17-21)18-37(32(23)36)30(29)31(38)35-26-9-4-5-10-28(26)39-3/h4-5,9-14,16-18H,6-8,15H2,1-3H3,(H,35,38)InChIKey
FXBRRJLWSLDGBR-UHFFFAOYSA-NSynonyms
879466-71-44(34dichlorophenyl)1(34dimethylphenyl)N(2methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
879466714
CC1=C(C=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC(=C(C=C5)Cl)Cl)C(=O)NC6=CC=CC=C6OC)C
InChI=1SC32H29Cl2N3O2c119111222(1620(19)2)2923867153627(21131424(33)25(34)1721)1837(32(23)36)30(29)31(38)35269451028(26)393h459141618H6815H213H3(H3538)
MFCD07208774
ZINC000098000373
ZINC98000373
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