Vitas-M small molecule compound
4-(4-chlorophenyl)-1-(4-fluorophenyl)-N-(2-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK587317
SMILES COc1ccccc1NC(=O)c1c(c2ccc(cc2)F)c2c3n1cc(n3CCCC2)c1ccc(cc1)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 C30H25ClFN3O2 MW 514.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25ClFN3O2/c1-37-26-8-3-2-7-24(26)33-29(36)28-27(20-11-15-22(32)16-12-20)23-6-4-5-17-34-25(18-35(28)30(23)34)19-9-13-21(31)14-10-19/h2-3,7-16,18H,4-6,17H2,1H3,(H,33,36)InChIKey
MNKCRIJVRJIYHS-UHFFFAOYSA-NSynonyms
896166-87-34(4chlorophenyl)1(4fluorophenyl)N(2methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896166873
COC1=CC=CC=C1NC(=O)C2=C(C3=C4N2C=C(N4CCCC3)C5=CC=C(C=C5)Cl)C6=CC=C(C=C6)F
InChI=1SC30H25ClFN3O2c13726832724(26)3329(36)2827(20111522(32)161220)23645173425(1835(28)30(23)34)1991321(31)141019h2371618H4617H21H3(H3336)
MFCD06603170
ZINC000002237543
ZINC02237543
ZINC2237543
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