Vitas-M small molecule compound
1-(3,4-dimethylphenyl)-N-(4-methoxyphenyl)-4-(4-methylphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK586678
SMILES COc1ccc(cc1)NC(=O)c1c(c2ccc(c(c2)C)C)c2c3n1cc(n3CCCC2)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 C33H33N3O2 MW 503.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33N3O2/c1-21-8-11-24(12-9-21)29-20-36-31(32(37)34-26-14-16-27(38-4)17-15-26)30(25-13-10-22(2)23(3)19-25)28-7-5-6-18-35(29)33(28)36/h8-17,19-20H,5-7,18H2,1-4H3,(H,34,37)InChIKey
FXEINZSXHAKSBS-UHFFFAOYSA-NSynonyms
896168-55-11(34dimethylphenyl)N(4methoxyphenyl)4(4methylphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
1(34dimethylphenyl)N(4methoxyphenyl)4(ptolyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896168551
CC1=CC=C(C=C1)C2=CN3C(=C(C4=C3N2CCCC4)C5=CC(=C(C=C5)C)C)C(=O)NC6=CC=C(C=C6)OC
InChI=1SC33H33N3O2c12181124(12921)29203631(32(37)3426141627(384)171526)30(25131022(2)23(3)1925)287561835(29)33(28)36h8171920H5718H214H3(H3437)
MFCD06605723
ZINC000002325826
ZINC02325826
ZINC2325826
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