Vitas-M small molecule compound

N,4-bis(4-chlorophenyl)-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide

Catalog ID
STL000940
SMILES COc1ccc(cc1)c1c(C(=O)Nc2ccc(cc2)Cl)n2c3c1CCCCn3c(c2)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 C30H25Cl2N3O2 MW 530.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25Cl2N3O2/c1-37-24-15-7-20(8-16-24)27-25-4-2-3-17-34-26(19-5-9-21(31)10-6-19)18-35(30(25)34)28(27)29(36)33-23-13-11-22(32)12-14-23/h5-16,18H,2-4,17H2,1H3,(H,33,36)
InChIKey
IUHOFYLHITYQHQ-UHFFFAOYSA-N
Synonyms
500272-46-8
500272468
COC1=CC=C(C=C1)C2=C(N3C=C(N4C3=C2CCCC4)C5=CC=C(C=C5)Cl)C(=O)NC6=CC=C(C=C6)Cl
InChI=1SC30H25Cl2N3O2c1372415720(81624)2725423173426(195921(31)10619)1835(30(25)34)28(27)29(36)3323131122(32)121423h51618H2417H21H3(H3336)
MFCD03302854
N4bis(4chlorophenyl)1(4methoxyphenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
ZINC000002446632
ZINC2446632

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Available files

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