N-[4-(3-phenylsulfanylpropylcarbamoyl)phenyl]furan-2-carboxamide

Systemtic Name: N-[4-(3-phenylsulfanylpropylcarbamoyl)phenyl]furan-2-carboxamide Openeye Name: N-[4-(3-phenylsulfanylpropylcarbamoyl)phenyl]furan-2-carboxamide CAS Name: N-[4-[oxo-[3-(phenylthio)propylamino]methyl]phenyl]-2-furancarboxamide IUPAC Name: N-[4-(3-phenylsulfanylpropylcarbamoyl)phenyl]furan-2-carboxamide Traditional Name: N-[4-[3-(phenylthio)propylcarbamoyl]phenyl]-2-furamide Formula: C21H20N2O3S MolecularWeight: 380.4601

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)SCCCNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C21H20N2O3S/c24-20(22-13-5-15-27-18-6-2-1-3-7-18)16-9-11-17(12-10-16)23-21(25)19-8-4-14-26-19/h1-4,6-12,14H,5,13,15H2,(H,22,24)(H,23,25)