Vitas-M small molecule compound
1-(4-methoxyphenyl)-4-(4-methylphenyl)-N-propyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STL006936
SMILES CCCNC(=O)c1c(c2ccc(cc2)OC)c2c3n1cc(n3CCCC2)c1ccc(cc1)C
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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 C28H31N3O2 MW 441.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O2/c1-4-16-29-27(32)26-25(21-12-14-22(33-3)15-13-21)23-7-5-6-17-30-24(18-31(26)28(23)30)20-10-8-19(2)9-11-20/h8-15,18H,4-7,16-17H2,1-3H3,(H,29,32)InChIKey
RIUJDLULTVMKKO-UHFFFAOYSA-NSynonyms
846582-09-01(4methoxyphenyl)4(4methylphenyl)Npropyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
1(4methoxyphenyl)Npropyl4(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
846582090
CCCNC(=O)C1=C(C2=C3N1C=C(N3CCCC2)C4=CC=C(C=C4)C)C5=CC=C(C=C5)OC
InChI=1SC28H31N3O2c14162927(32)2625(21121422(333)151321)23756173024(1831(26)28(23)30)2010819(2)91120h81518H471617H213H3(H2932)
MFCD04175317
ZINC000009304798
ZINC09304798
ZINC9304798
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