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

Systemtic Name: N-(3-cyano-4,5-diphenyl-furan-2-yl)-2-(6-methylpyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(3-cyano-4,5-diphenyl-2-furyl)-2-(6-methylpyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(3-cyano-4,5-diphenyl-2-furanyl)-2-[(6-methyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(3-cyano-4,5-diphenylfuran-2-yl)-2-(6-methylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(3-cyano-4,5-diphenyl-2-furyl)-2-[(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)SC(C)C(=O)NC2=C(C(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

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

InChI

InChI=1S/C25H20N4O2S/c1-16-13-21(28-15-27-16)32-17(2)24(30)29-25-20(14-26)22(18-9-5-3-6-10-18)23(31-25)19-11-7-4-8-12-19/h3-13,15,17H,1-2H3,(H,29,30)