Vitas-M small molecule compound
methyl 3-(2-hydroxyethyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate
Catalog ID
STK206860
SMILES OCCn1c(=S)[nH]c2c(c1=O)ccc(c2)C(=O)OC
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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 C12H12N2O4S MW 280.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O4S/c1-18-11(17)7-2-3-8-9(6-7)13-12(19)14(4-5-15)10(8)16/h2-3,6,15H,4-5H2,1H3,(H,13,19)InChIKey
NLNCQQCCTAYWHA-UHFFFAOYSA-NSynonyms
725691-79-2COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CCO
InChI=1SC12H12N2O4Sc11811(17)72389(67)1312(19)14(4515)10(8)16h23615H45H21H3(H1319)
METHYL3(2HYDROXYETHYL)2MERCAPTO4OXO34DIHYDROQUINAZOLINE7CARBOXYLATE
METHYL3(2HYDROXYETHYL)4OXO2SULFANYL34DIHYDROQUINAZOLINE7CARBOXYLATE
METHYL3(2HYDROXYETHYL)4OXO2SULFANYLIDENE1HQUINAZOLINE7CARBOXYLATE
methyl3(2hydroxyethyl)4oxo2thioxo1234tetrahydroquinazoline7carboxylate
METHYL3(2HYDROXYETHYL)4OXO2THIOXO13DIHYDROQUINAZOLINE7CARBOXYLATE
MFCD06136609
OCCn1c(=S)(nH)c2c(c1=O)ccc(c2)C(=O)OC
ZINC100432918
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