Vitas-M small molecule compound
4-(3,4-dichlorophenyl)-N-(3-methoxyphenyl)-1-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK598973
SMILES COc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccccc1)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 C30H25Cl2N3O2 MW 530.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25Cl2N3O2/c1-37-22-11-7-10-21(17-22)33-29(36)28-27(19-8-3-2-4-9-19)23-12-5-6-15-34-26(18-35(28)30(23)34)20-13-14-24(31)25(32)16-20/h2-4,7-11,13-14,16-18H,5-6,12,15H2,1H3,(H,33,36)InChIKey
QJCONALLEOONEC-UHFFFAOYSA-NSynonyms
896169-25-84(34dichlorophenyl)N(3methoxyphenyl)1phenyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
896169258
COC1=CC=CC(=C1)NC(=O)C2=C(C3=C4N2C=C(N4CCCC3)C5=CC(=C(C=C5)Cl)Cl)C6=CC=CC=C6
InChI=1SC30H25Cl2N3O2c137221171021(1722)3329(36)2827(198324919)231256153426(1835(28)30(23)34)20131424(31)25(32)1620h2471113141618H561215H21H3(H3336)
MFCD06609676
ZINC000002346112
ZINC2346112
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