Vitas-M small molecule compound
propan-2-yl 5-(3-fluorophenyl)-7-methyl-2-[(2-methylpropyl)sulfanyl]-4-oxo-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK980948
SMILES CC(CSc1nc2NC(=C(C(c2c(=O)[nH]1)c1cccc(c1)F)C(=O)OC(C)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 C22H26FN3O3S MW 431.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26FN3O3S/c1-11(2)10-30-22-25-19-18(20(27)26-22)17(14-7-6-8-15(23)9-14)16(13(5)24-19)21(28)29-12(3)4/h6-9,11-12,17H,10H2,1-5H3,(H2,24,25,26,27)InChIKey
FHIJWBAVZBHVDX-UHFFFAOYSA-NSynonyms
CC(CSc1nc2NC(=C(C(c2c(=O)(nH)1)c1cccc(c1)F)C(=O)OC(C)C)C)C
CC1=C(C(C2=C(N1)NC(=NC2=O)SCC(C)C)C3=CC(=CC=C3)F)C(=O)OC(C)C
InChI=1SC22H26FN3O3Sc111(2)103022251918(20(27)2622)17(1476815(23)914)16(13(5)2419)21(28)2912(3)4h69111217H10H215H3(H224252627)
MFCD08488661
propan2yl5(3fluorophenyl)7methyl2((2methylpropyl)sulfanyl)4oxo3458tetrahydropyrido(23d)pyrimidine6carboxylate
propan2yl5(3fluorophenyl)7methyl2(2methylpropylsulfanyl)4oxo58dihydro1Hpyrido(23d)pyrimidine6carboxylate
ZINC000013117849
ZINC000013117850
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