Vitas-M small molecule compound

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

Catalog ID
STK659888
SMILES Clc1ccc(cc1)NC(=O)c1n2nc(n3c2c(c1c1ccccc1)CCCC3)c1ccc(cc1)Br

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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 C28H22BrClN4O MW 545.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22BrClN4O/c29-20-11-9-19(10-12-20)26-32-34-25(27(35)31-22-15-13-21(30)14-16-22)24(18-6-2-1-3-7-18)23-8-4-5-17-33(26)28(23)34/h1-3,6-7,9-16H,4-5,8,17H2,(H,31,35)
InChIKey
DUIVQKKZEDFDKZ-UHFFFAOYSA-N
Synonyms
325995-65-1
1(4bromophenyl)N(4chlorophenyl)4phenyl5678tetrahydro22a8atriazacyclopenta(cd)azulene3carboxamide
325995651
4(4bromophenyl)N(4chlorophenyl)1phenyl5678tetrahydro2a34atriazacyclopenta(cd)azulene2carboxamide
C1CCN2C3=C(C1)C(=C(N3N=C2C4=CC=C(C=C4)Br)C(=O)NC5=CC=C(C=C5)Cl)C6=CC=CC=C6
InChI=1SC28H22BrClN4Oc292011919(101220)26323425(27(35)3122151321(30)141622)24(186213718)238451733(26)28(23)34h1367916H45817H2(H3135)
MFCD02251973
ZINC000002251174
ZINC2251174

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Available files

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