Vitas-M small molecule compound

2-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}-3-(4-methylphenyl)-2,3-dihydroquinazolin-4(1H)-one

Catalog ID
STK996904
SMILES COc1ccc(cc1CSc1nc2c(s1)cccc2)C1Nc2ccccc2C(=O)N1c1ccc(cc1)C

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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 C30H25N3O2S2 MW 523.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N3O2S2/c1-19-11-14-22(15-12-19)33-28(31-24-8-4-3-7-23(24)29(33)34)20-13-16-26(35-2)21(17-20)18-36-30-32-25-9-5-6-10-27(25)37-30/h3-17,28,31H,18H2,1-2H3
InChIKey
WIJAYUJUVGGHFM-UHFFFAOYSA-N
Synonyms
352660-49-2
(2R)2(3((13BENZOTHIAZOL2YLSULFANYL)METHYL)4METHOXYPHENYL)3(4METHYLPHENYL)23DIHYDROQUINAZOLIN4(1H)ONE
2(3((13BENZOTHIAZOL2YLSULFANYL)METHYL)4METHOXYPHENYL)3(4METHYLPHENYL)23DIHYDRO4(1H)QUINAZOLINONE
2(3((13benzothiazol2ylsulfanyl)methyl)4methoxyphenyl)3(4methylphenyl)23dihydroquinazolin4(1H)one
2(3((benzo(d)thiazol2ylthio)methyl)4methoxyphenyl)3(ptolyl)23dihydroquinazolin4(1H)one
2(3(13BENZOTHIAZOL2YLSULFANYLMETHYL)4METHOXYPHENYL)3(4METHYLPHENYL)12DIHYDROQUINAZOLIN4ONE
352660492
CC1=CC=C(C=C1)N2C(NC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)OC)CSC5=NC6=CC=CC=C6S5
InChI=1SC30H25N3O2S2c119111422(151219)3328(3124843723(24)29(33)34)20131626(352)21(1720)18363032259561027(25)3730h3172831H18H212H3
MFCD02946861
ZINC000002238717
ZINC000002238718

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Available files

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