Vitas-M small molecule compound
N,4-bis(4-methoxyphenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Catalog ID
STL001371
SMILES COc1ccc(cc1)NC(=S)c1n2cc(n3c2c(c1c1ccccc1)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 C31H29N3O2S MW 507.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N3O2S/c1-35-24-15-11-21(12-16-24)27-20-34-29(30(37)32-23-13-17-25(36-2)18-14-23)28(22-8-4-3-5-9-22)26-10-6-7-19-33(27)31(26)34/h3-5,8-9,11-18,20H,6-7,10,19H2,1-2H3,(H,32,37)InChIKey
HGFJXVPULHXJDR-UHFFFAOYSA-NSynonyms
488826-64-8488826648
COC1=CC=C(C=C1)C2=CN3C(=C(C4=C3N2CCCC4)C5=CC=CC=C5)C(=S)NC6=CC=C(C=C6)OC
InChI=1SC31H29N3O2Sc13524151121(121624)27203429(30(37)3223131725(362)181423)28(228435922)2610671933(27)31(26)34h3589111820H671019H212H3(H3237)
MFCD03294035
N4bis(4methoxyphenyl)1phenyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
ZINC000002372770
ZINC02372770
ZINC2372770
Check stock
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Check stock on Vitas-MAvailable files
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