Vitas-M small molecule compound
methyl 4-oxo-3-(2-phenylethyl)-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Catalog ID
STK207524
SMILES COC(=O)c1ccc2c(c1)[nH]c(=S)n(c2=O)CCc1ccccc1
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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 C18H16N2O3S MW 340.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O3S/c1-23-17(22)13-7-8-14-15(11-13)19-18(24)20(16(14)21)10-9-12-5-3-2-4-6-12/h2-8,11H,9-10H2,1H3,(H,19,24)InChIKey
VTJFKHZYOMPUJU-UHFFFAOYSA-NSynonyms
309750-70-7309750707
COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CCC3=CC=CC=C3
COC(=O)c1ccc2c(c1)(nH)c(=S)n(c2=O)CCc1ccccc1
InChI=1SC18H16N2O3Sc12317(22)13781415(1113)1918(24)20(16(14)21)109125324612h2811H910H21H3(H1924)
METHYL2MERCAPTO4OXO3(2PHENYLETHYL)34DIHYDROQUINAZOLINE7CARBOXYLATE
METHYL4OXO3(2PHENYLETHYL)2SULFANYL34DIHYDROQUINAZOLINE7CARBOXYLATE
methyl4oxo3(2phenylethyl)2sulfanylidene1Hquinazoline7carboxylate
methyl4oxo3(2phenylethyl)2thioxo1234tetrahydroquinazoline7carboxylate
METHYL4OXO3(2PHENYLETHYL)2THIOXO13DIHYDROQUINAZOLINE7CARBOXYLATE
METHYL4OXO3PHENETHYL2SULFANYLIDENE1HQUINAZOLINE7CARBOXYLATE
MFCD02088021
ZINC000100432930
ZINC03394842
ZINC100432930
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Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.