Vitas-M small molecule compound

N-(3-chlorophenyl)-1,4-diphenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide

Catalog ID
STL000431
SMILES Clc1cccc(c1)NC(=O)c1n2cc(n3c2c(c1c1ccccc1)CCCC3)c1ccccc1

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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 C29H24ClN3O MW 465.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24ClN3O/c30-22-14-9-15-23(18-22)31-28(34)27-26(21-12-5-2-6-13-21)24-16-7-8-17-32-25(19-33(27)29(24)32)20-10-3-1-4-11-20/h1-6,9-15,18-19H,7-8,16-17H2,(H,31,34)
InChIKey
ZITIAZSORKKRSS-UHFFFAOYSA-N
Synonyms
488811-45-6
488811456
C1CCN2C(=CN3C2=C(C1)C(=C3C(=O)NC4=CC(=CC=C4)Cl)C5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC29H24ClN3Oc30221491523(1822)3128(34)2726(21125261321)241678173225(1933(27)29(24)32)20103141120h169151819H781617H2(H3134)
N(3chlorophenyl)14diphenyl5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
ZINC02406045
ZINC2406045

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.