Vitas-M small molecule compound
methyl 2-(benzylsulfanyl)-3-[2-(1H-imidazol-4-yl)ethyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Catalog ID
STK207142
SMILES COC(=O)c1ccc2c(c1)nc(n(c2=O)CCc1c[nH]cn1)SCc1ccccc1
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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 C22H20N4O3S MW 420.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3S/c1-29-21(28)16-7-8-18-19(11-16)25-22(30-13-15-5-3-2-4-6-15)26(20(18)27)10-9-17-12-23-14-24-17/h2-8,11-12,14H,9-10,13H2,1H3,(H,23,24)InChIKey
FCVJBGXCGGAIJJ-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC=CC=C3)CCC4=CN=CN4
COC(=O)c1ccc2c(c1)nc(n(c2=O)CCc1c(nH)cn1)SCc1ccccc1
InChI=1SC22H20N4O3Sc12921(28)16781819(1116)2522(3013155324615)26(20(18)27)109171223142417h28111214H91013H21H3(H2324)
methyl2(benzylsulfanyl)3(2(1Himidazol4yl)ethyl)4oxo34dihydroquinazoline7carboxylate
METHYL2BENZYLSULFANYL3(2(1HIMIDAZOL5YL)ETHYL)4OXOQUINAZOLINE7CARBOXYLATE
METHYL3(2IMIDAZOL4YLETHYL)4OXO2(PHENYLMETHYLTHIO)3HYDROQUINAZOLINE7CARBOXYLATE
MFCD06015330
ZINC000009972240
ZINC09972240
ZINC9972240
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