Vitas-M small molecule compound
1-(4-methoxyphenyl)-N-(4-methylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK580970
SMILES COc1ccc(cc1)c1c(C(=O)Nc2ccc(cc2)C)n2c3c1CCCCn3c(c2)c1ccccc1
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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 C31H29N3O2 MW 475.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O2/c1-21-11-15-24(16-12-21)32-30(35)29-28(23-13-17-25(36-2)18-14-23)26-10-6-7-19-33-27(20-34(29)31(26)33)22-8-4-3-5-9-22/h3-5,8-9,11-18,20H,6-7,10,19H2,1-2H3,(H,32,35)InChIKey
RHKKPLLFMSCCSE-UHFFFAOYSA-NSynonyms
896168-15-31(4methoxyphenyl)4phenylN(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
1(4methoxyphenyl)N(4methylphenyl)4phenyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896168153
CC1=CC=C(C=C1)NC(=O)C2=C(C3=C4N2C=C(N4CCCC3)C5=CC=CC=C5)C6=CC=C(C=C6)OC
InChI=1SC31H29N3O2c121111524(161221)3230(35)2928(23131725(362)181423)261067193327(2034(29)31(26)33)228435922h3589111820H671019H212H3(H3235)
MFCD06604063
ZINC000002241707
ZINC02241707
ZINC2241707
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