N-(3-cyano-4,5-diphenyl-furan-2-yl)-3-(6-methylpyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(3-cyano-4,5-diphenyl-furan-2-yl)-3-(6-methylpyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(3-cyano-4,5-diphenyl-2-furyl)-3-(6-methylpyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(3-cyano-4,5-diphenyl-2-furanyl)-3-[(6-methyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(3-cyano-4,5-diphenylfuran-2-yl)-3-(6-methylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(3-cyano-4,5-diphenyl-2-furyl)-3-[(6-methylpyrimidin-4-yl)thio]propionamide Formula: C25H20N4O2S MolecularWeight: 440.5169

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)SCCC(=O)NC2=C(C(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=CC(=NC=N1)SCCC(=O)NC2=C(C(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C25H20N4O2S/c1-17-14-22(28-16-27-17)32-13-12-21(30)29-25-20(15-26)23(18-8-4-2-5-9-18)24(31-25)19-10-6-3-7-11-19/h2-11,14,16H,12-13H2,1H3,(H,29,30)