Vitas-M small molecule compound
methyl 4-oxo-3-(pyridin-3-ylmethyl)-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Catalog ID
STK207444
SMILES COC(=O)c1ccc2c(c1)[nH]c(=S)n(c2=O)Cc1cccnc1
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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 C16H13N3O3S MW 327.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O3S/c1-22-15(21)11-4-5-12-13(7-11)18-16(23)19(14(12)20)9-10-3-2-6-17-8-10/h2-8H,9H2,1H3,(H,18,23)InChIKey
AWAPPPLGHUKXEI-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC3=CN=CC=C3
COC(=O)c1ccc2c(c1)(nH)c(=S)n(c2=O)Cc1cccnc1
InChI=1SC16H13N3O3Sc12215(21)11451213(711)1816(23)19(14(12)20)91032617810h28H9H21H3(H1823)
METHYL4OXO3(3PYRIDYLMETHYL)2THIOXO13DIHYDROQUINAZOLINE7CARBOXYLATE
METHYL4OXO3(PYRIDIN3YLMETHYL)2SULFANYLIDENE1HQUINAZOLINE7CARBOXYLATE
methyl4oxo3(pyridin3ylmethyl)2thioxo1234tetrahydroquinazoline7carboxylate
MFCD02650952
ZINC000000424954
ZINC00424954
ZINC424954
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