Vitas-M small molecule compound
5-(4-chlorophenyl)-2-[(4-nitrobenzyl)sulfanyl]-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK981061
SMILES Clc1ccc(cc1)C1C2=C(CCCC2=O)Nc2c1c(=O)[nH]c(n2)SCc1ccc(cc1)[N+](=O)[O-]
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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 C24H19ClN4O4S MW 494.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN4O4S/c25-15-8-6-14(7-9-15)19-20-17(2-1-3-18(20)30)26-22-21(19)23(31)28-24(27-22)34-12-13-4-10-16(11-5-13)29(32)33/h4-11,19H,1-3,12H2,(H2,26,27,28,31)InChIKey
CLFARWCPROCVEJ-UHFFFAOYSA-NSynonyms
537043-40-65(4chlorophenyl)2((4nitrobenzyl)sulfanyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
5(4chlorophenyl)2((4nitrophenyl)methylsulfanyl)1578910hexahydropyrimido(45b)quinoline46dione
537043406
C1CC2=C(C(C3=C(N2)NC(=NC3=O)SCC4=CC=C(C=C4)(N+)(=O)(O))C5=CC=C(C=C5)Cl)C(=O)C1
Clc1ccc(cc1)C1C2=C(CCCC2=O)Nc2c1c(=O)(nH)c(n2)SCc1ccc(cc1)(N+)(=O)(O)
InChI=1SC24H19ClN4O4Sc25158614(7915)192017(21318(20)30)262221(19)23(31)2824(2722)34121341016(11513)29(32)33h41119H1312H2(H226272831)
MFCD05037377
ZINC000017155927
ZINC000017155931
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