Vitas-M small molecule compound
(10Z)-10-{[5-(2-methyl-3-nitrophenyl)furan-2-yl]methylidene}-7-(thiophen-2-yl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK742951
SMILES O=c1/c(=C/c2ccc(o2)c2cccc(c2C)[N+](=O)[O-])/sc2=NC3=C(C(n12)c1cccs1)CCc1c3cccc1
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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 C30H21N3O4S2 MW 551.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H21N3O4S2/c1-17-20(8-4-9-23(17)33(35)36)24-14-12-19(37-24)16-26-29(34)32-28(25-10-5-15-38-25)22-13-11-18-6-2-3-7-21(18)27(22)31-30(32)39-26/h2-10,12,14-16,28H,11,13H2,1H3/b26-16-InChIKey
DIVQYLRIROALKE-QQXSKIMKSA-NSynonyms
(10Z)10((5(2methyl3nitrophenyl)furan2yl)methylidene)7(thiophen2yl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(Z)10((5(2methyl3nitrophenyl)furan2yl)methylene)7(thiophen2yl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
CC1=C(C=CC=C1(N+)(=O)(O))C2=CC=C(O2)C=C3C(=O)N4C(C5=C(C6=CC=CC=C6CC5)N=C4S3)C7=CC=CS7
InChI=1SC30H21N3O4S2c11720(84923(17)33(35)36)24141219(3724)162629(34)3228(25105153825)22131118623721(18)27(22)3130(32)3926h21012141628H1113H21H3b2616
MFCD03665876
O=c1c(=Cc2ccc(o2)c2cccc(c2C)(N+)(=O)(O))sc2=NC3=C(C(n12)c1cccs1)CCc1c3cccc1
ZINC000102658337
ZINC000102658340
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