Vitas-M small molecule compound
4-(4-chlorophenyl)-1-(4-ethoxyphenyl)-N-(3-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK576277
SMILES CCOc1ccc(cc1)c1c(C(=O)Nc2cccc(c2)OC)n2c3c1CCCCn3c(c2)c1ccc(cc1)Cl
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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 C32H30ClN3O3 MW 540.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30ClN3O3/c1-3-39-25-16-12-22(13-17-25)29-27-9-4-5-18-35-28(21-10-14-23(33)15-11-21)20-36(32(27)35)30(29)31(37)34-24-7-6-8-26(19-24)38-2/h6-8,10-17,19-20H,3-5,9,18H2,1-2H3,(H,34,37)InChIKey
DNPJTQWDJDOARH-UHFFFAOYSA-NSynonyms
896168-23-34(4chlorophenyl)1(4ethoxyphenyl)N(3methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896168233
CCOC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=C(C=C5)Cl)C(=O)NC6=CC(=CC=C6)OC
InChI=1SC32H30ClN3O3c133925161222(131725)2927945183528(21101423(33)151121)2036(32(27)35)30(29)31(37)342476826(1924)382h6810171920H35918H212H3(H3437)
MFCD06613904
ZINC000002364925
ZINC2364925
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