Vitas-M small molecule compound
ethyl 2-{[6-iodo-4-oxo-3-(prop-2-en-1-yl)-3,4-dihydroquinazolin-2-yl]sulfanyl}propanoate
Catalog ID
STK547113
SMILES C=CCn1c(SC(C(=O)OCC)C)nc2c(c1=O)cc(cc2)I
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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 C16H17IN2O3S MW 444.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17IN2O3S/c1-4-8-19-14(20)12-9-11(17)6-7-13(12)18-16(19)23-10(3)15(21)22-5-2/h4,6-7,9-10H,1,5,8H2,2-3H3InChIKey
LWGMKEYBJCXAMV-UHFFFAOYSA-NSynonyms
488813-31-6488813316
CCOC(=O)C(C)SC1=NC2=C(C=C(C=C2)I)C(=O)N1CC=C
ethyl2((3allyl6iodo4oxo34dihydroquinazolin2yl)thio)propanoate
ethyl2((6iodo4oxo3(prop2en1yl)34dihydroquinazolin2yl)sulfanyl)propanoate
ETHYL2(6IODO4OXO3PROP2ENYLQUINAZOLIN2YL)SULFANYLPROPANOATE
InChI=1SC16H17IN2O3Sc1481914(20)12911(17)6713(12)1816(19)2310(3)15(21)2252h467910H158H223H3
MFCD03293672
ZINC000002360104
ZINC000002360106
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