Vitas-M small molecule compound
N-(3,4-dimethylphenyl)-N-[(4-phenyl-3-propanoyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulen-1-yl)methyl]propanamide
Catalog ID
STK780352
SMILES CCC(=O)N(c1ccc(c(c1)C)C)Cc1nn2c3n1CCCCc3c(c2C(=O)CC)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 C30H34N4O2 MW 482.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O2/c1-5-25(35)29-28(22-12-8-7-9-13-22)24-14-10-11-17-32-26(31-34(29)30(24)32)19-33(27(36)6-2)23-16-15-20(3)21(4)18-23/h7-9,12-13,15-16,18H,5-6,10-11,14,17,19H2,1-4H3InChIKey
JFCZMLLTMYGLBM-UHFFFAOYSA-NSynonyms
CCC(=O)C1=C(C2=C3N1N=C(N3CCCC2)CN(C4=CC(=C(C=C4)C)C)C(=O)CC)C5=CC=CC=C5
InChI=1SC30H34N4O2c1525(35)2928(22128791322)24141011173226(3134(29)30(24)32)1933(27(36)62)23161520(3)21(4)1823h791213151618H561011141719H214H3
MFCD05860280
N(34dimethylphenyl)N((4phenyl3propanoyl5678tetrahydro22a8atriazacyclopenta(cd)azulen1yl)methyl)propanamide
ZINC000012418383
ZINC12418383
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