Vitas-M small molecule compound
1-(4-chlorophenyl)-N,4-bis(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK599477
SMILES COc1ccc(cc1)NC(=O)c1n2cc(n3c2c(c1c1ccc(cc1)Cl)CCCC3)c1ccc(cc1)OC
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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 C31H28ClN3O3 MW 526.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28ClN3O3/c1-37-24-14-8-20(9-15-24)27-19-35-29(30(36)33-23-12-16-25(38-2)17-13-23)28(21-6-10-22(32)11-7-21)26-5-3-4-18-34(27)31(26)35/h6-17,19H,3-5,18H2,1-2H3,(H,33,36)InChIKey
GINYJUBFSQCCSY-UHFFFAOYSA-NSynonyms
896071-25-31(4chlorophenyl)N4bis(4methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896071253
COC1=CC=C(C=C1)C2=CN3C(=C(C4=C3N2CCCC4)C5=CC=C(C=C5)Cl)C(=O)NC6=CC=C(C=C6)OC
InChI=1SC31H28ClN3O3c1372414820(91524)27193529(30(36)3323121625(382)171323)28(2161022(32)11721)265341834(27)31(26)35h61719H3518H212H3(H3336)
MFCD06591731
ZINC000002433658
ZINC02433658
ZINC2433658
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