Vitas-M small molecule compound
4-(3,4-dichlorophenyl)-N-(2-methoxyphenyl)-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STL057281
SMILES COc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1ccccc1OC)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 C31H27Cl2N3O3 MW 560.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27Cl2N3O3/c1-38-21-13-10-19(11-14-21)28-22-7-5-6-16-35-26(20-12-15-23(32)24(33)17-20)18-36(31(22)35)29(28)30(37)34-25-8-3-4-9-27(25)39-2/h3-4,8-15,17-18H,5-7,16H2,1-2H3,(H,34,37)InChIKey
ZVWZYIWUWJKJSU-UHFFFAOYSA-NSynonyms
879436-73-44(34dichlorophenyl)N(2methoxyphenyl)1(4methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
879436734
COC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC(=C(C=C5)Cl)Cl)C(=O)NC6=CC=CC=C6OC
InChI=1SC31H27Cl2N3O3c13821131019(111421)2822756163526(20121523(32)24(33)1720)1836(31(22)35)29(28)30(37)3425834927(25)392h348151718H5716H212H3(H3437)
MFCD07201099
ZINC000098000361
ZINC98000361
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