Vitas-M small molecule compound
1,4-bis(4-bromophenyl)-N-(3-chlorophenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide
Catalog ID
STK687516
SMILES Brc1ccc(cc1)c1cn2c3n1CCCCc3c(c2C(=O)Nc1cccc(c1)Cl)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 C29H22Br2ClN3O MW 623.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22Br2ClN3O/c30-20-11-7-18(8-12-20)25-17-35-27(28(36)33-23-5-3-4-22(32)16-23)26(19-9-13-21(31)14-10-19)24-6-1-2-15-34(25)29(24)35/h3-5,7-14,16-17H,1-2,6,15H2,(H,33,36)InChIKey
MYXBDPOFWVBLKL-UHFFFAOYSA-NSynonyms
14bis(4bromophenyl)N(3chlorophenyl)5678tetrahydro2a4adiazacyclopenta(cd)azulene2carboxamide
C1CCN2C(=CN3C2=C(C1)C(=C3C(=O)NC4=CC(=CC=C4)Cl)C5=CC=C(C=C5)Br)C6=CC=C(C=C6)Br
InChI=1SC29H22Br2ClN3Oc302011718(81220)25173527(28(36)332353422(32)1623)26(1991321(31)141019)246121534(25)29(24)35h357141617H12615H2(H3336)
MFCD03287061
ZINC000098008376
ZINC98008376
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