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

Systemtic Name: N-(3-cyano-4,5-diphenyl-furan-2-yl)-3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(3-cyano-4,5-diphenyl-2-furyl)-3-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(3-cyano-4,5-diphenyl-2-furanyl)-3-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(3-cyano-4,5-diphenylfuran-2-yl)-3-(2-methyl-6-phenylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(3-cyano-4,5-diphenyl-2-furyl)-3-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]propionamide Formula: C31H24N4O2S MolecularWeight: 516.61286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)SCCC(=O)NC2=C(C(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)C#N)C5=CC=CC=C5

Isomeric SMILES

CC1=NC(=CC(=N1)SCCC(=O)NC2=C(C(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C31H24N4O2S/c1-21-33-26(22-11-5-2-6-12-22)19-28(34-21)38-18-17-27(36)35-31-25(20-32)29(23-13-7-3-8-14-23)30(37-31)24-15-9-4-10-16-24/h2-16,19H,17-18H2,1H3,(H,35,36)