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

Systemtic Name: N-(3-cyano-4,5-diphenyl-furan-2-yl)-2-(4-methylquinolin-2-yl)sulfanyl-butanamide Openeye Name: N-(3-cyano-4,5-diphenyl-2-furyl)-2-[(4-methyl-2-quinolyl)sulfanyl]butanamide CAS Name: N-(3-cyano-4,5-diphenyl-2-furanyl)-2-[(4-methyl-2-quinolinyl)thio]butanamide IUPAC Name: N-(3-cyano-4,5-diphenylfuran-2-yl)-2-(4-methylquinolin-2-yl)sulfanylbutanamide Traditional Name: N-(3-cyano-4,5-diphenyl-2-furyl)-2-[(4-methyl-2-quinolyl)thio]butyramide Formula: C31H25N3O2S MolecularWeight: 503.6141

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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=NC5=CC=CC=C5C(=C4)C

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3)C#N)SC4=NC5=CC=CC=C5C(=C4)C

InChI

InChI=1S/C31H25N3O2S/c1-3-26(37-27-18-20(2)23-16-10-11-17-25(23)33-27)30(35)34-31-24(19-32)28(21-12-6-4-7-13-21)29(36-31)22-14-8-5-9-15-22/h4-18,26H,3H2,1-2H3,(H,34,35)