Vitas-M small molecule compound
1-(4-bromophenyl)-N-(3,4-dichlorophenyl)-4-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK998892
SMILES COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccc(c(c1)Cl)Cl)c1ccc(cc1)Br
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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 C30H24BrCl2N3O2 MW 609.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24BrCl2N3O2/c1-38-22-12-7-18(8-13-22)26-17-36-28(29(37)34-21-11-14-24(32)25(33)16-21)27(19-5-9-20(31)10-6-19)23-4-2-3-15-35(26)30(23)36/h5-14,16-17H,2-4,15H2,1H3,(H,34,37)InChIKey
IZNXTMJWNNYFKO-UHFFFAOYSA-NSynonyms
1(4bromophenyl)N(34dichlorophenyl)4(4methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
COC1=CC=C(C=C1)C2=CN3C(=C(C4=C3N2CCCC4)C5=CC=C(C=C5)Br)C(=O)NC6=CC(=C(C=C6)Cl)Cl
InChI=1SC30H24BrCl2N3O2c1382212718(81322)26173628(29(37)3421111424(32)25(33)1621)27(195920(31)10619)234231535(26)30(23)36h5141617H2415H21H3(H3437)
MFCD03287763
ZINC000097999804
ZINC97999804
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