Vitas-M small molecule compound
methyl 3-benzyl-4-oxo-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Catalog ID
STK207435
SMILES COC(=O)c1ccc2c(c1)[nH]c(=S)n(c2=O)Cc1ccccc1
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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 C17H14N2O3S MW 326.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O3S/c1-22-16(21)12-7-8-13-14(9-12)18-17(23)19(15(13)20)10-11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,18,23)InChIKey
XXYDXJYQWAUGQW-UHFFFAOYSA-NSynonyms
310448-89-6310448896
COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC3=CC=CC=C3
COC(=O)c1ccc2c(c1)(nH)c(=S)n(c2=O)Cc1ccccc1
InChI=1SC17H14N2O3Sc12216(21)12781314(912)1817(23)19(15(13)20)10115324611h29H10H21H3(H1823)
METHYL3BENZYL2MERCAPTO4OXO34DIHYDROQUINAZOLINE7CARBOXYLATE
METHYL3BENZYL4OXO2SULFANYLIDENE1HQUINAZOLINE7CARBOXYLATE
methyl3benzyl4oxo2thioxo1234tetrahydroquinazoline7carboxylate
METHYL4OXO3BENZYL2THIOXO13DIHYDROQUINAZOLINE7CARBOXYLATE
MFCD02088019
ZINC000003311555
ZINC02445140
ZINC03311555
ZINC3311555
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