Vitas-M small molecule compound
methyl 3-{2-[(4-methylphenyl)sulfanyl]ethyl}-4-oxo-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Catalog ID
STK206864
SMILES COC(=O)c1ccc2c(c1)[nH]c(=S)n(c2=O)CCSc1ccc(cc1)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 C19H18N2O3S2 MW 386.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O3S2/c1-12-3-6-14(7-4-12)26-10-9-21-17(22)15-8-5-13(18(23)24-2)11-16(15)20-19(21)25/h3-8,11H,9-10H2,1-2H3,(H,20,25)InChIKey
FEHPSSWIIDHNSU-UHFFFAOYSA-NSynonyms
725691-88-3CC1=CC=C(C=C1)SCCN2C(=O)C3=C(C=C(C=C3)C(=O)OC)NC2=S
COC(=O)c1ccc2c(c1)(nH)c(=S)n(c2=O)CCSc1ccc(cc1)C
InChI=1SC19H18N2O3S2c1123614(7412)261092117(22)158513(18(23)242)1116(15)2019(21)25h3811H910H212H3(H2025)
METHYL3(2((4METHYLPHENYL)SULFANYL)ETHYL)4OXO2SULFANYL34DIHYDROQUINAZOLINE7CARBOXYLATE
methyl3(2((4methylphenyl)sulfanyl)ethyl)4oxo2thioxo1234tetrahydroquinazoline7carboxylate
METHYL3(2(4METHYLPHENYL)SULFANYLETHYL)4OXO2SULFANYLIDENE1HQUINAZOLINE7CARBOXYLATE
METHYL3(2(4METHYLPHENYLTHIO)ETHYL)4OXO2THIOXO13DIHYDROQUINAZOLINE7CARBOXYLATE
methyl4oxo2thioxo3(2(ptolylthio)ethyl)1234tetrahydroquinazoline7carboxylate
MFCD06136619
ZINC100432934
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