Vitas-M small molecule compound

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

Catalog ID
STK980774
SMILES CCSc1nc2NC3=C(C(c2c(=O)[nH]1)c1ccc(cc1)C(C)C)C(=O)CC(C3)(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 C24H29N3O2S MW 423.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O2S/c1-6-30-23-26-21-20(22(29)27-23)18(15-9-7-14(8-10-15)13(2)3)19-16(25-21)11-24(4,5)12-17(19)28/h7-10,13,18H,6,11-12H2,1-5H3,(H2,25,26,27,29)
InChIKey
OPDXHSONWSCNQI-UHFFFAOYSA-N
Synonyms

2(ethylsulfanyl)88dimethyl5(4(propan2yl)phenyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
2ethylsulfanyl88dimethyl5(4propan2ylphenyl)57910tetrahydro1Hpyrimido(45b)quinoline46dione
CCSC1=NC(=O)C2=C(N1)NC3=C(C2C4=CC=C(C=C4)C(C)C)C(=O)CC(C3)(C)C
CCSc1nc2NC3=C(C(c2c(=O)(nH)1)c1ccc(cc1)C(C)C)C(=O)CC(C3)(C)C
InChI=1SC24H29N3O2Sc163023262120(22(29)2723)18(159714(81015)13(2)3)1916(2521)1124(45)1217(19)28h7101318H61112H215H3(H225262729)
MFCD04457351
ZINC000006001469
ZINC000006001896

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Available files

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