Vitas-M small molecule compound
4,4'-bis(4-chlorophenyl)-5,5',6,6',7,7',8,8'-octahydro-1,1'-bi-2,2a,8a-triazacyclopenta[cd]azulene
Catalog ID
STL281521
SMILES Clc1ccc(cc1)c1cn2c3c1CCCCn3c(n2)c1nn2c3n1CCCCc3c(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 C30H26Cl2N6 MW 541.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26Cl2N6/c31-21-11-7-19(8-12-21)25-17-37-29-23(25)5-1-3-15-35(29)27(33-37)28-34-38-18-26(20-9-13-22(32)14-10-20)24-6-2-4-16-36(28)30(24)38/h7-14,17-18H,1-6,15-16H2InChIKey
JYFZHCKGLSJGNY-UHFFFAOYSA-NSynonyms
44bis(4chlorophenyl)55667788octahydro11bi22a8atriazacyclopenta(cd)azulene
C1CCN2C3=C(C1)C(=CN3N=C2C4=NN5C=C(C6=C5N4CCCC6)C7=CC=C(C=C7)Cl)C8=CC=C(C=C8)Cl
InChI=1SC30H26Cl2N6c312111719(81221)2517372923(25)5131535(29)27(3337)2834381826(2091322(32)141020)246241636(28)30(24)38h7141718H161516H2
MFCD01595270
ZINC000008694496
ZINC8694496
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