Vitas-M small molecule compound
(2E)-2-benzylidene-9-(1,3-dithian-2-ylidene)-5-phenyl-5a,6,7,8,9,9a-hexahydro-5H-[1,3]thiazolo[2,3-b]quinazolin-3(2H)-one
Catalog ID
STK993184
SMILES O=c1/c(=C\c2ccccc2)/sc2=NC3C(C(n12)c1ccccc1)CCCC3=C1SCCCS1
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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 C27H26N2OS3 MW 490.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2OS3/c30-25-22(17-18-9-3-1-4-10-18)33-27-28-23-20(24(29(25)27)19-11-5-2-6-12-19)13-7-14-21(23)26-31-15-8-16-32-26/h1-6,9-12,17,20,23-24H,7-8,13-16H2/b22-17+InChIKey
FGZWXCFYVCSFAJ-OQKWZONESA-NSynonyms
(2E)2benzylidene9(13dithian2ylidene)5phenyl55a6789ahexahydro(13)thiazolo(23b)quinazolin3one
(2E)2benzylidene9(13dithian2ylidene)5phenyl5a67899ahexahydro5H(13)thiazolo(23b)quinazolin3(2H)one
C1CC2C(C(=C3SCCCS3)C1)N=C4N(C2C5=CC=CC=C5)C(=O)C(=CC6=CC=CC=C6)S4
InChI=1SC27H26N2OS3c302522(171893141018)3327282320(24(29(25)27)19115261219)1371421(23)2631158163226h1691217202324H781316H2b2217+
MFCD18184775
O=c1c(=Cc2ccccc2)sc2=NC3C(C(n12)c1ccccc1)CCCC3=C1SCCCS1
ZINC000226325457
ZINC000245255067
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