Vitas-M small molecule compound
N-(3-chlorophenyl)-4-(4-fluorophenyl)-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STL000425
SMILES COc1ccc(cc1)c1c2CCCCn3c2n(c1C(=O)Nc1cccc(c1)Cl)cc3c1ccc(cc1)F
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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 C30H25ClFN3O2 MW 514.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25ClFN3O2/c1-37-24-14-10-20(11-15-24)27-25-7-2-3-16-34-26(19-8-12-22(32)13-9-19)18-35(30(25)34)28(27)29(36)33-23-6-4-5-21(31)17-23/h4-6,8-15,17-18H,2-3,7,16H2,1H3,(H,33,36)InChIKey
PLPMMYWEQKALGH-UHFFFAOYSA-NSynonyms
848221-55-6848221556
COC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=C(C=C5)F)C(=O)NC6=CC(=CC=C6)Cl
InChI=1SC30H25ClFN3O2c13724141020(111524)2725723163426(1981222(32)13919)1835(30(25)34)28(27)29(36)332364521(31)1723h468151718H23716H21H3(H3336)
MFCD04189841
N(3chlorophenyl)4(4fluorophenyl)1(4methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
ZINC000002425376
ZINC02425376
ZINC2425376
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