Vitas-M small molecule compound
2-(ethylsulfanyl)-5-(3,4,5-trimethoxyphenyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK980663
SMILES CCSc1nc2NC3=C(C(c2c(=O)[nH]1)c1cc(OC)c(c(c1)OC)OC)C(=O)CCC3
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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 C22H25N3O5S MW 443.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O5S/c1-5-31-22-24-20-18(21(27)25-22)16(17-12(23-20)7-6-8-13(17)26)11-9-14(28-2)19(30-4)15(10-11)29-3/h9-10,16H,5-8H2,1-4H3,(H2,23,24,25,27)InChIKey
ZIXVZKADWVKGPF-UHFFFAOYSA-NSynonyms
2(ethylsulfanyl)5(345trimethoxyphenyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
2ethylsulfanyl5(345trimethoxyphenyl)1578910hexahydropyrimido(45b)quinoline46dione
CCSC1=NC(=O)C2=C(N1)NC3=C(C2C4=CC(=C(C(=C4)OC)OC)OC)C(=O)CCC3
CCSc1nc2NC3=C(C(c2c(=O)(nH)1)c1cc(OC)c(c(c1)OC)OC)C(=O)CCC3
InChI=1SC22H25N3O5Sc153122242018(21(27)2522)16(1712(2320)76813(17)26)11914(282)19(304)15(1011)293h91016H58H214H3(H223242527)
MFCD04457255
ZINC000017316776
ZINC000017316779
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