Vitas-M small molecule compound
methyl 2-(benzylsulfanyl)-7-methyl-4-oxo-5-(thiophen-2-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK981009
SMILES COC(=O)C1=C(C)Nc2c(C1c1cccs1)c(=O)[nH]c(n2)SCc1ccccc1
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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 C21H19N3O3S2 MW 425.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O3S2/c1-12-15(20(26)27-2)16(14-9-6-10-28-14)17-18(22-12)23-21(24-19(17)25)29-11-13-7-4-3-5-8-13/h3-10,16H,11H2,1-2H3,(H2,22,23,24,25)InChIKey
CDTJVVHHQNYUOW-UHFFFAOYSA-NSynonyms
537047-01-1537047011
CC1=C(C(C2=C(N1)NC(=NC2=O)SCC3=CC=CC=C3)C4=CC=CS4)C(=O)OC
COC(=O)C1=C(C)Nc2c(C1c1cccs1)c(=O)(nH)c(n2)SCc1ccccc1
InChI=1SC21H19N3O3S2c11215(20(26)272)16(1496102814)1718(2212)2321(2419(17)25)2911137435813h31016H11H212H3(H222232425)
methyl2(benzylsulfanyl)7methyl4oxo5(thiophen2yl)3458tetrahydropyrido(23d)pyrimidine6carboxylate
METHYL2BENZYLSULFANYL7METHYL4OXO5THIOPHEN2YL58DIHYDRO1HPYRIDO(23D)PYRIMIDINE6CARBOXYLATE
MFCD04457440
ZINC000100821744
ZINC000100821746
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