Vitas-M small molecule compound

2-(1,3-benzodioxol-5-yl)-3-{[(E)-1,3-benzodioxol-5-ylmethylidene]amino}-2,3-dihydroquinazolin-4(1H)-one

Catalog ID
STK026021
SMILES O=C1c2ccccc2NC(N1/N=C/c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2

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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 C23H17N3O5 MW 415.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O5/c27-23-16-3-1-2-4-17(16)25-22(15-6-8-19-21(10-15)31-13-29-19)26(23)24-11-14-5-7-18-20(9-14)30-12-28-18/h1-11,22,25H,12-13H2/b24-11+
InChIKey
BIGXJXFHZFXUEC-BHGWPJFGSA-N
Synonyms
334504-64-2
(E)2(benzo(d)(13)dioxol5yl)3((benzo(d)(13)dioxol5ylmethylene)amino)23dihydroquinazolin4(1H)one
2(13BENZODIOXOL5YL)3(((E)13BENZODIOXOL5YLMETHYLIDENE)AMINO)23DIHYDROQUINAZOLIN4(1H)ONE
2(13benzodioxol5yl)3((E)13benzodioxol5ylmethylideneamino)12dihydroquinazolin4one
3((1E)2(2HBENZO(34D)13DIOXOLAN5YL)1AZAVINYL)2(2HBENZO(34D)13DIOXOLEN5YL)123TRIHYDROQUINAZOLIN4ONE
334504642
C1OC2=C(O1)C=C(C=C2)C=NN3C(NC4=CC=CC=C4C3=O)C5=CC6=C(C=C5)OCO6
InChI=1SC23H17N3O5c272316312417(16)2522(15681921(1015)31132919)26(23)241114571820(914)30122818h1112225H1213H2b2411+
MFCD01613564
O=C1c2ccccc2NC(N1N=Cc1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2
STK026021
ZINC000000849528
ZINC000000849530

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Available files

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