Vitas-M small molecule compound
1-(4-ethoxyphenyl)-N-(4-methylphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK589419
SMILES CCOc1ccc(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 C32H31N3O2 MW 489.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3O2/c1-3-37-26-18-14-24(15-19-26)29-27-11-7-8-20-34-28(23-9-5-4-6-10-23)21-35(32(27)34)30(29)31(36)33-25-16-12-22(2)13-17-25/h4-6,9-10,12-19,21H,3,7-8,11,20H2,1-2H3,(H,33,36)InChIKey
ANCMLRUFPYUHNA-UHFFFAOYSA-NSynonyms
896167-39-81(4ethoxyphenyl)4phenylN(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
1(4ethoxyphenyl)N(4methylphenyl)4phenyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896167398
CCOC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=CC=C5)C(=O)NC6=CC=C(C=C6)C
InChI=1SC32H31N3O2c133726181424(151926)29271178203428(2395461023)2135(32(27)34)30(29)31(36)3325161222(2)131725h46910121921H3781120H212H3(H3336)
MFCD06596692
ZINC000002205331
ZINC02205331
ZINC2205331
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