Vitas-M small molecule compound
methyl 3-[3-(morpholin-4-yl)propyl]-4-oxo-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Catalog ID
STK207440
SMILES COC(=O)c1ccc2c(c1)[nH]c(=S)n(c2=O)CCCN1CCOCC1
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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 C17H21N3O4S MW 363.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O4S/c1-23-16(22)12-3-4-13-14(11-12)18-17(25)20(15(13)21)6-2-5-19-7-9-24-10-8-19/h3-4,11H,2,5-10H2,1H3,(H,18,25)InChIKey
VCTOAUMZVSSDKK-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CCCN3CCOCC3
COC(=O)c1ccc2c(c1)(nH)c(=S)n(c2=O)CCCN1CCOCC1
InChI=1SC17H21N3O4Sc12316(22)12341314(1112)1817(25)20(15(13)21)62519792410819h3411H2510H21H3(H1825)
methyl3(3(morpholin4yl)propyl)4oxo2thioxo1234tetrahydroquinazoline7carboxylate
METHYL3(3MORPHOLIN4YLPROPYL)4OXO2SULFANYLIDENE1HQUINAZOLINE7CARBOXYLATE
METHYL3(3MORPHOLIN4YLPROPYL)4OXO2THIOXO13DIHYDROQUINAZOLINE7CARBOXYLATE
MFCD05023893
ZINC000002332524
ZINC2332524
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