Vitas-M small molecule compound
propan-2-yl 7-methyl-2-[(2-methylpropyl)sulfanyl]-4-oxo-5-(thiophen-2-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK981017
SMILES CC(CSc1nc2NC(=C(C(c2c(=O)[nH]1)c1cccs1)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 C20H25N3O3S2 MW 419.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O3S2/c1-10(2)9-28-20-22-17-16(18(24)23-20)15(13-7-6-8-27-13)14(12(5)21-17)19(25)26-11(3)4/h6-8,10-11,15H,9H2,1-5H3,(H2,21,22,23,24)InChIKey
SJYMPLLSFJKPIH-UHFFFAOYSA-NSynonyms
CC(CSc1nc2NC(=C(C(c2c(=O)(nH)1)c1cccs1)C(=O)OC(C)C)C)C
CC1=C(C(C2=C(N1)NC(=NC2=O)SCC(C)C)C3=CC=CS3)C(=O)OC(C)C
InChI=1SC20H25N3O3S2c110(2)92820221716(18(24)2320)15(137682713)14(12(5)2117)19(25)2611(3)4h68101115H9H215H3(H221222324)
MFCD09236894
propan2yl7methyl2((2methylpropyl)sulfanyl)4oxo5(thiophen2yl)3458tetrahydropyrido(23d)pyrimidine6carboxylate
propan2yl7methyl2(2methylpropylsulfanyl)4oxo5thiophen2yl58dihydro1Hpyrido(23d)pyrimidine6carboxylate
ZINC000017243085
ZINC000017243092
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