Vitas-M small molecule compound

(8E)-8-(4-chlorobenzylidene)-4-(4-chlorophenyl)-2-(methylsulfanyl)-3,4,5,6,7,8-hexahydroquinazoline

Catalog ID
STL115130
SMILES CSC1=NC2=C(C(N1)c1ccc(cc1)Cl)CCC/C/2=C\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 C22H20Cl2N2S MW 415.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20Cl2N2S/c1-27-22-25-20(15-7-11-18(24)12-8-15)19-4-2-3-16(21(19)26-22)13-14-5-9-17(23)10-6-14/h5-13,20H,2-4H2,1H3,(H,25,26)/b16-13+
InChIKey
KLHZPIQXLHOTBC-DTQAZKPQSA-N
Synonyms

(8E)4(4chlorophenyl)8((4chlorophenyl)methylidene)2methylsulfanyl4567tetrahydro1Hquinazoline
(8E)8(4chlorobenzylidene)4(4chlorophenyl)2(methylsulfanyl)345678hexahydroquinazoline
CSC1=NC(C2=C(N1)C(=CC3=CC=C(C=C3)Cl)CCC2)C4=CC=C(C=C4)Cl
CSC1=NC2=C(C(N1)c1ccc(cc1)Cl)CCCC2=Cc1ccc(cc1)Cl
InChI=1SC22H20Cl2N2Sc127222520(1571118(24)12815)1942316(21(19)2622)13145917(23)10614h51320H24H21H3(H2526)b1613+
MFCD03177088
ZINC000006378747
ZINC000018212412

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Available files

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