Vitas-M small molecule compound
methyl 2-(ethylsulfanyl)-5-[4-(methoxycarbonyl)phenyl]-7-methyl-4-oxo-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK980892
SMILES CCSc1nc2NC(=C(C(c2c(=O)[nH]1)c1ccc(cc1)C(=O)OC)C(=O)OC)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 C20H21N3O5S MW 415.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O5S/c1-5-29-20-22-16-15(17(24)23-20)14(13(10(2)21-16)19(26)28-4)11-6-8-12(9-7-11)18(25)27-3/h6-9,14H,5H2,1-4H3,(H2,21,22,23,24)InChIKey
SDWAMTCFRLOENF-UHFFFAOYSA-NSynonyms
CCSC1=NC(=O)C2=C(N1)NC(=C(C2C3=CC=C(C=C3)C(=O)OC)C(=O)OC)C
CCSc1nc2NC(=C(C(c2c(=O)(nH)1)c1ccc(cc1)C(=O)OC)C(=O)OC)C
InChI=1SC20H21N3O5Sc152920221615(17(24)2320)14(13(10(2)2116)19(26)284)116812(9711)18(25)273h6914H5H214H3(H221222324)
methyl2(ethylsulfanyl)5(4(methoxycarbonyl)phenyl)7methyl4oxo3458tetrahydropyrido(23d)pyrimidine6carboxylate
methyl2ethylsulfanyl5(4methoxycarbonylphenyl)7methyl4oxo58dihydro1Hpyrido(23d)pyrimidine6carboxylate
MFCD04426386
ZINC000101238660
ZINC000101238663
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