Vitas-M small molecule compound
4-(3,4-dichlorophenyl)-1-(4-ethylphenyl)-N-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK582760
SMILES CCc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1)cc3c1ccc(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 C31H27Cl2N3O MW 528.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27Cl2N3O/c1-2-20-11-13-21(14-12-20)28-24-10-6-7-17-35-27(22-15-16-25(32)26(33)18-22)19-36(31(24)35)29(28)30(37)34-23-8-4-3-5-9-23/h3-5,8-9,11-16,18-19H,2,6-7,10,17H2,1H3,(H,34,37)InChIKey
KOCIBDFPKQKXDQ-UHFFFAOYSA-NSynonyms
896168-62-04(34dichlorophenyl)1(4ethylphenyl)Nphenyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896168620
CCC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC(=C(C=C5)Cl)Cl)C(=O)NC6=CC=CC=C6
InChI=1SC31H27Cl2N3Oc1220111321(141220)28241067173527(22151625(32)26(33)1822)1936(31(24)35)29(28)30(37)34238435923h358911161819H2671017H21H3(H3437)
MFCD06613660
ZINC000002364094
ZINC2364094
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