Vitas-M small molecule compound

prop-2-en-1-yl 7-methyl-2-[(2-methylpropyl)sulfanyl]-4-oxo-5-(pyridin-4-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate

Catalog ID
STK981003
SMILES C=CCOC(=O)C1=C(C)Nc2c(C1c1ccncc1)c(=O)[nH]c(n2)SCC(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 C21H24N4O3S MW 412.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O3S/c1-5-10-28-20(27)15-13(4)23-18-17(16(15)14-6-8-22-9-7-14)19(26)25-21(24-18)29-11-12(2)3/h5-9,12,16H,1,10-11H2,2-4H3,(H2,23,24,25,26)
InChIKey
GAJUTIVDBCBMGA-UHFFFAOYSA-N
Synonyms
876865-44-0
876865440
C=CCOC(=O)C1=C(C)Nc2c(C1c1ccncc1)c(=O)(nH)c(n2)SCC(C)C
CC1=C(C(C2=C(N1)NC(=NC2=O)SCC(C)C)C3=CC=NC=C3)C(=O)OCC=C
InChI=1SC21H24N4O3Sc15102820(27)1513(4)231817(16(15)1468229714)19(26)2521(2418)291112(2)3h591216H11011H224H3(H223242526)
MFCD07803254
prop2en1yl7methyl2((2methylpropyl)sulfanyl)4oxo5(pyridin4yl)3458tetrahydropyrido(23d)pyrimidine6carboxylate
prop2enyl7methyl2(2methylpropylsulfanyl)4oxo5pyridin4yl58dihydro1Hpyrido(23d)pyrimidine6carboxylate
ZINC000004292293
ZINC000004292294

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Available files

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