Vitas-M small molecule compound
N,1-bis(4-methoxyphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Catalog ID
STK781132
SMILES COc1ccc(cc1)c1c(C(=S)Nc2ccc(cc2)OC)n2c3c1CCCCn3c(c2)c1ccc(cc1)C
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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 C32H31N3O2S MW 521.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3O2S/c1-21-7-9-22(10-8-21)28-20-35-30(31(38)33-24-13-17-26(37-3)18-14-24)29(23-11-15-25(36-2)16-12-23)27-6-4-5-19-34(28)32(27)35/h7-18,20H,4-6,19H2,1-3H3,(H,33,38)InChIKey
YKPRXGQAHANBTN-UHFFFAOYSA-NSynonyms
488715-27-1488715271
CC1=CC=C(C=C1)C2=CN3C(=C(C4=C3N2CCCC4)C5=CC=C(C=C5)OC)C(=S)NC6=CC=C(C=C6)OC
InChI=1SC32H31N3O2Sc1217922(10821)28203530(31(38)3324131726(373)181424)29(23111525(362)161223)276451934(28)32(27)35h71820H4619H213H3(H3338)
MFCD03290927
N1bis(4methoxyphenyl)4(4methylphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
N1bis(4methoxyphenyl)4(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carbothioamide
ZINC000002336396
ZINC02336396
ZINC2336396
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