Vitas-M small molecule compound
2-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}-3-(4-methoxyphenyl)-2,3-dihydroquinazolin-4(1H)-one
Catalog ID
STK723127
SMILES COc1ccc(cc1)N1C(Nc2c(C1=O)cccc2)c1ccc(c(c1)CSc1nc2c(s1)cccc2)OC
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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 C30H25N3O3S2 MW 539.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N3O3S2/c1-35-22-14-12-21(13-15-22)33-28(31-24-8-4-3-7-23(24)29(33)34)19-11-16-26(36-2)20(17-19)18-37-30-32-25-9-5-6-10-27(25)38-30/h3-17,28,31H,18H2,1-2H3InChIKey
DOZIVCHEVHTNIL-UHFFFAOYSA-NSynonyms
312626-76-92(3((13benzothiazol2ylsulfanyl)methyl)4methoxyphenyl)3(4methoxyphenyl)23dihydroquinazolin4(1H)one
2(3((benzo(d)thiazol2ylthio)methyl)4methoxyphenyl)3(4methoxyphenyl)23dihydroquinazolin4(1H)one
2(3(13BENZOTHIAZOL2YLSULFANYLMETHYL)4METHOXYPHENYL)3(4METHOXYPHENYL)12DIHYDROQUINAZOLIN4ONE
2(3(BENZOTHIAZOL2YLTHIOMETHYL)4METHOXYPHENYL)3(4METHOXYPHENYL)123TRIHYDROQUINAZOLIN4ONE
312626769
COC1=CC=C(C=C1)N2C(NC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)OC)CSC5=NC6=CC=CC=C6S5
InChI=1SC30H25N3O3S2c13522141221(131522)3328(3124843723(24)29(33)34)19111626(362)20(1719)18373032259561027(25)3830h3172831H18H212H3
MFCD01956456
ZINC000097950351
ZINC000097950352
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