Vitas-M small molecule compound
N-(2-chlorophenyl)-4-(4-methoxyphenyl)-1-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK598266
SMILES COc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1ccccc1Cl)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 C31H28ClN3O2 MW 510.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28ClN3O2/c1-20-10-12-22(13-11-20)28-24-7-5-6-18-34-27(21-14-16-23(37-2)17-15-21)19-35(31(24)34)29(28)30(36)33-26-9-4-3-8-25(26)32/h3-4,8-17,19H,5-7,18H2,1-2H3,(H,33,36)InChIKey
DRWCDNWUXDOPQW-UHFFFAOYSA-NSynonyms
849917-67-5849917675
CC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=C(C=C5)OC)C(=O)NC6=CC=CC=C6Cl
InChI=1SC31H28ClN3O2c120101222(131120)2824756183427(21141623(372)171521)1935(31(24)34)29(28)30(36)3326943825(26)32h3481719H5718H212H3(H3336)
MFCD05689090
N(2chlorophenyl)4(4methoxyphenyl)1(4methylphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
N(2chlorophenyl)4(4methoxyphenyl)1(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
ZINC000002201716
ZINC02201716
ZINC2201716
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