Vitas-M small molecule compound
4-(3,4-dichlorophenyl)-1-(4-fluorophenyl)-N-(3-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK574848
SMILES COc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccc(cc1)F)CCCC3)c1ccc(c(c1)Cl)Cl
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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 C30H24Cl2FN3O2 MW 548.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24Cl2FN3O2/c1-38-22-6-4-5-21(16-22)34-29(37)28-27(18-8-11-20(33)12-9-18)23-7-2-3-14-35-26(17-36(28)30(23)35)19-10-13-24(31)25(32)15-19/h4-6,8-13,15-17H,2-3,7,14H2,1H3,(H,34,37)InChIKey
ZOEMRQBGSJIVTK-UHFFFAOYSA-NSynonyms
896169-74-74(34dichlorophenyl)1(4fluorophenyl)N(3methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896169747
COC1=CC=CC(=C1)NC(=O)C2=C(C3=C4N2C=C(N4CCCC3)C5=CC(=C(C=C5)Cl)Cl)C6=CC=C(C=C6)F
InChI=1SC30H24Cl2FN3O2c1382264521(1622)3429(37)2827(1881120(33)12918)23723143526(1736(28)30(23)35)19101324(31)25(32)1519h468131517H23714H21H3(H3437)
MFCD06613399
ZINC000002363134
ZINC2363134
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