Vitas-M small molecule compound
N-(4-methylphenyl)-1,4-diphenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carbothioamide
Catalog ID
STL006528
SMILES Cc1ccc(cc1)NC(=S)c1c(c2ccccc2)c2c3n1nc(n3CCCC2)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 C29H26N4S MW 462.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4S/c1-20-15-17-23(18-16-20)30-28(34)26-25(21-10-4-2-5-11-21)24-14-8-9-19-32-27(31-33(26)29(24)32)22-12-6-3-7-13-22/h2-7,10-13,15-18H,8-9,14,19H2,1H3,(H,30,34)InChIKey
ZEIOPFMHRCMAIW-UHFFFAOYSA-NSynonyms
540773-38-414diphenylN(ptolyl)5678tetrahydro2a34atriazacyclopenta(cd)azulene2carbothioamide
540773384
CC1=CC=C(C=C1)NC(=S)C2=C(C3=C4N2N=C(N4CCCC3)C5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC29H26N4Sc120151723(181620)3028(34)2625(21104251121)241489193227(3133(26)29(24)32)22126371322h2710131518H891419H21H3(H3034)
MFCD03460412
N(4methylphenyl)14diphenyl5678tetrahydro22a8atriazacyclopenta(cd)azulene3carbothioamide
ZINC000002245922
ZINC02245922
ZINC2245922
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