Vitas-M small molecule compound
8,8-dimethyl-2-[(3-methylbutyl)sulfanyl]-5-(5-methylthiophen-2-yl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK918770
SMILES CC(CCSc1nc2NC3=C(C(c2c(=O)[nH]1)c1ccc(s1)C)C(=O)CC(C3)(C)C)C
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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 C23H29N3O2S2 MW 443.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O2S2/c1-12(2)8-9-29-22-25-20-19(21(28)26-22)18(16-7-6-13(3)30-16)17-14(24-20)10-23(4,5)11-15(17)27/h6-7,12,18H,8-11H2,1-5H3,(H2,24,25,26,28)InChIKey
PDRVXBFJQMIYBD-UHFFFAOYSA-NSynonyms
631855-00-0631855000
88dimethyl2((3methylbutyl)sulfanyl)5(5methylthiophen2yl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
88dimethyl2(3methylbutylsulfanyl)5(5methylthiophen2yl)57910tetrahydro1Hpyrimido(45b)quinoline46dione
CC(CCSc1nc2NC3=C(C(c2c(=O)(nH)1)c1ccc(s1)C)C(=O)CC(C3)(C)C)C
CC1=CC=C(S1)C2C3=C(CC(CC3=O)(C)C)NC4=C2C(=O)N=C(N4)SCCC(C)C
InChI=1SC23H29N3O2S2c112(2)892922252019(21(28)2622)18(167613(3)3016)1714(2420)1023(45)1115(17)27h671218H811H215H3(H224252628)
MFCD04444018
ZINC000009494402
ZINC000017121679
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