Vitas-M small molecule compound
1-(4-methoxyphenyl)-N-(3-methylphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK597377
SMILES COc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1cccc(c1)C)cc3c1ccc(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 C32H31N3O2 MW 489.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3O2/c1-21-10-12-23(13-11-21)28-20-35-30(31(36)33-25-8-6-7-22(2)19-25)29(24-14-16-26(37-3)17-15-24)27-9-4-5-18-34(28)32(27)35/h6-8,10-17,19-20H,4-5,9,18H2,1-3H3,(H,33,36)InChIKey
DPLQRLGLQKCGMZ-UHFFFAOYSA-NSynonyms
896167-08-11(4methoxyphenyl)N(3methylphenyl)4(4methylphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
1(4methoxyphenyl)N(mtolyl)4(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896167081
CC1=CC=C(C=C1)C2=CN3C(=C(C4=C3N2CCCC4)C5=CC=C(C=C5)OC)C(=O)NC6=CC=CC(=C6)C
InChI=1SC32H31N3O2c121101223(131121)28203530(31(36)332586722(2)1925)29(24141626(373)171524)279451834(28)32(27)35h6810171920H45918H213H3(H3336)
MFCD06599228
ZINC000002218045
ZINC02218045
ZINC2218045
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