N-(3-cyano-4,5-diphenyl-furan-2-yl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3)C#N)SC4=NC=NC(=C4)C5=CC=CC=C5

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3)C#N)SC4=NC=NC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H24N4O2S/c1-2-26(38-27-18-25(33-20-34-27)21-12-6-3-7-13-21)30(36)35-31-24(19-32)28(22-14-8-4-9-15-22)29(37-31)23-16-10-5-11-17-23/h3-18,20,26H,2H2,1H3,(H,35,36)