Vitas-M small molecule compound

5-(2,5-dimethoxyphenyl)-2-(ethylsulfanyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione

Catalog ID
STK980662
SMILES CCSc1nc2NC3=C(C(c2c(=O)[nH]1)c1cc(OC)ccc1OC)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 C21H23N3O4S MW 413.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4S/c1-4-29-21-23-19-18(20(26)24-21)16(17-13(22-19)6-5-7-14(17)25)12-10-11(27-2)8-9-15(12)28-3/h8-10,16H,4-7H2,1-3H3,(H2,22,23,24,26)
InChIKey
JOTZVODPLKBOMT-UHFFFAOYSA-N
Synonyms

5(25dimethoxyphenyl)2(ethylsulfanyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
5(25dimethoxyphenyl)2ethylsulfanyl1578910hexahydropyrimido(45b)quinoline46dione
CCSC1=NC(=O)C2=C(N1)NC3=C(C2C4=C(C=CC(=C4)OC)OC)C(=O)CCC3
CCSc1nc2NC3=C(C(c2c(=O)(nH)1)c1cc(OC)ccc1OC)C(=O)CCC3
InChI=1SC21H23N3O4Sc142921231918(20(26)2421)16(1713(2219)65714(17)25)121011(272)8915(12)283h81016H47H213H3(H222232426)
MFCD04065213
ZINC000018088750
ZINC000018126552

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Available files

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