Vitas-M small molecule compound
4-(5-{(Z)-[1-(2,3-dimethylphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzonitrile
Catalog ID
STK192373
SMILES N#Cc1ccc(cc1)c1ccc(o1)/C=C\1/C(=O)NC(=S)N(C1=O)c1cccc(c1C)C
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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 C24H17N3O3S MW 427.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17N3O3S/c1-14-4-3-5-20(15(14)2)27-23(29)19(22(28)26-24(27)31)12-18-10-11-21(30-18)17-8-6-16(13-25)7-9-17/h3-12H,1-2H3,(H,26,28,31)/b19-12-InChIKey
SWBASXAZZYMRLG-UNOMPAQXSA-NSynonyms
4(5((Z)(1(23DIMETHYLPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZONITRILE
4(5((Z)(1(23DIMETHYLPHENYL)46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)FURAN2YL)BENZONITRILE
CC1=C(C(=CC=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)C#N)C(=O)NC2=S)C
InChI=1SC24H17N3O3Sc11443520(15(14)2)2723(29)19(22(28)2624(27)31)1218101121(3018)178616(1325)7917h312H12H3(H262831)b1912
MFCD04087280
N#Cc1ccc(cc1)c1ccc(o1)C=C1C(=O)NC(=S)N(C1=O)c1cccc(c1C)C
ZINC000009262825
ZINC09262825
ZINC9262825
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