Vitas-M small molecule compound

(10Z)-7-(2,3-dimethoxyphenyl)-10-(thiophen-2-ylmethylidene)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one

Catalog ID
STK988419
SMILES COc1cccc(c1OC)C1C2=C(N=c3n1c(=O)/c(=C/c1cccs1)/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 C27H22N2O3S2 MW 486.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O3S2/c1-31-21-11-5-10-20(25(21)32-2)24-19-13-12-16-7-3-4-9-18(16)23(19)28-27-29(24)26(30)22(34-27)15-17-8-6-14-33-17/h3-11,14-15,24H,12-13H2,1-2H3/b22-15-
InChIKey
JMAKJOOKOWISIF-JCMHNJIXSA-N
Synonyms
472973-66-3
(10Z)7(23dimethoxyphenyl)10(thiophen2ylmethylidene)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(Z)7(23dimethoxyphenyl)10(thiophen2ylmethylene)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
472973663
COC1=CC=CC(=C1OC)C2C3=C(C4=CC=CC=C4CC3)N=C5N2C(=O)C(=CC6=CC=CS6)S5
COc1cccc(c1OC)C1C2=C(N=c3n1c(=O)c(=Cc1cccs1)s3)c1c(CC2)cccc1
InChI=1SC27H22N2O3S2c131211151020(25(21)322)2419131216734918(16)23(19)282729(24)26(30)22(3427)151786143317h311141524H1213H212H3b2215
MFCD03253973
ZINC000002178522
ZINC000002178524

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Available files

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