Vitas-M small molecule compound
methyl 2-(butylsulfanyl)-5-[4-(methoxycarbonyl)phenyl]-7-methyl-4-oxo-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK981069
SMILES CCCCSc1nc2NC(=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 C22H25N3O5S MW 443.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O5S/c1-5-6-11-31-22-24-18-17(19(26)25-22)16(15(12(2)23-18)21(28)30-4)13-7-9-14(10-8-13)20(27)29-3/h7-10,16H,5-6,11H2,1-4H3,(H2,23,24,25,26)InChIKey
NGFBZUXUIIMCHC-UHFFFAOYSA-NSynonyms
876866-16-9876866169
CCCCSC1=NC(=O)C2=C(N1)NC(=C(C2C3=CC=C(C=C3)C(=O)OC)C(=O)OC)C
CCCCSc1nc2NC(=C(C(c2c(=O)(nH)1)c1ccc(cc1)C(=O)OC)C(=O)OC)C
InChI=1SC22H25N3O5Sc156113122241817(19(26)2522)16(15(12(2)2318)21(28)304)137914(10813)20(27)293h71016H5611H214H3(H223242526)
methyl2(butylsulfanyl)5(4(methoxycarbonyl)phenyl)7methyl4oxo3458tetrahydropyrido(23d)pyrimidine6carboxylate
methyl2butylsulfanyl5(4methoxycarbonylphenyl)7methyl4oxo58dihydro1Hpyrido(23d)pyrimidine6carboxylate
MFCD07803239
ZINC000016046744
ZINC000016046745
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