Vitas-M small molecule compound
(10Z)-7-(2-methoxyphenyl)-10-[(5-nitrofuran-2-yl)methylidene]-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STL406203
SMILES COc1ccccc1C1C2=C(N=c3n1c(=O)/c(=C/c1ccc(o1)[N+](=O)[O-])/s3)c1c(CC2)cccc1
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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 C26H19N3O5S MW 485.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N3O5S/c1-33-20-9-5-4-8-18(20)24-19-12-10-15-6-2-3-7-17(15)23(19)27-26-28(24)25(30)21(35-26)14-16-11-13-22(34-16)29(31)32/h2-9,11,13-14,24H,10,12H2,1H3/b21-14-InChIKey
CVBITYHFPVAHCO-STZFKDTASA-NSynonyms
(10Z)7(2methoxyphenyl)10((5nitrofuran2yl)methylidene)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
COC1=CC=CC=C1C2C3=C(C4=CC=CC=C4CC3)N=C5N2C(=O)C(=CC6=CC=C(O6)(N+)(=O)(O))S5
COc1ccccc1C1C2=C(N=c3n1c(=O)c(=Cc1ccc(o1)(N+)(=O)(O))s3)c1c(CC2)cccc1
InChI=1SC26H19N3O5Sc13320954818(20)2419121015623717(15)23(19)272628(24)25(30)21(3526)1416111322(3416)29(31)32h2911131424H1012H21H3b2114
MFCD30704420
ZINC000223207994
ZINC000223208048
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