Vitas-M small molecule compound

4-{(Z)-[9-oxo-7-(thiophen-2-yl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-10(9H)-ylidene]methyl}benzoic acid

Catalog ID
STK065730
SMILES OC(=O)c1ccc(cc1)/C=c/1\sc2=NC3=C(C(n2c1=O)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 C26H18N2O3S2 MW 470.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18N2O3S2/c29-24-21(14-15-7-9-17(10-8-15)25(30)31)33-26-27-22-18-5-2-1-4-16(18)11-12-19(22)23(28(24)26)20-6-3-13-32-20/h1-10,13-14,23H,11-12H2,(H,30,31)/b21-14-
InChIKey
UOIFVLTYDZCPRQ-STZFKDTASA-N
Synonyms
445405-12-9
(Z)4((9oxo7(thiophen2yl)5Hbenzo(h)thiazolo(23b)quinazolin10(6H7H9H)ylidene)methyl)benzoicacid
4((Z)(9OXO7(THIOPHEN2YL)57DIHYDRO6HBENZO(H)(13)THIAZOLO(23B)QUINAZOLIN10(9H)YLIDENE)METHYL)BENZOICACID
445405129
C1CC2=C(C3=CC=CC=C31)N=C4N(C2C5=CC=CS5)C(=O)C(=CC6=CC=C(C=C6)C(=O)O)S4
InChI=1SC26H18N2O3S2c292421(14157917(10815)25(30)31)3326272218521416(18)111219(22)23(28(24)26)2063133220h110131423H1112H2(H3031)b2114
MFCD04168880
OC(=O)c1ccc(cc1)C=c1sc2=NC3=C(C(n2c1=O)c1cccs1)CCc1c3cccc1
STK065730
ZINC000002120969
ZINC000009281770

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Available files

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