Vitas-M small molecule compound
4-{5-[(1,3-diethyl-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]furan-2-yl}benzonitrile
Catalog ID
STK190217
SMILES N#Cc1ccc(cc1)c1ccc(o1)C=C1C(=O)N(CC)C(=S)N(C1=O)CC
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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 C20H17N3O3S MW 379.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O3S/c1-3-22-18(24)16(19(25)23(4-2)20(22)27)11-15-9-10-17(26-15)14-7-5-13(12-21)6-8-14/h5-11H,3-4H2,1-2H3InChIKey
ABZAKTRAKNOJED-UHFFFAOYSA-NSynonyms
4(5((13DIETHYL46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZONITRILE
4(5((13DIETHYL46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)FURAN2YL)BENZONITRILE
CCN1C(=O)C(=CC2=CC=C(O2)C3=CC=C(C=C3)C#N)C(=O)N(C1=S)CC
InChI=1SC20H17N3O3Sc132218(24)16(19(25)23(42)20(22)27)111591017(2615)147513(1221)6814h511H34H212H3
MFCD03697088
ZINC000000661203
ZINC00661203
ZINC661203
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