N-[4-[5-(2-azanylethylcarbamoyl)furan-2-yl]phenyl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[4-[5-(2-azanylethylcarbamoyl)furan-2-yl]phenyl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[4-[5-(2-aminoethylcarbamoyl)-2-furyl]phenyl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[4-[5-[(2-aminoethylamino)-oxomethyl]-2-furanyl]phenyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-[4-[5-(2-aminoethylcarbamoyl)furan-2-yl]phenyl]-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-[4-[5-(2-aminoethylcarbamoyl)-2-furyl]phenyl]-2-(phenylthio)nicotinamide Formula: C25H22N4O3S MolecularWeight: 458.53218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)C4=CC=C(O4)C(=O)NCCN

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)C4=CC=C(O4)C(=O)NCCN

InChI

InChI=1S/C25H22N4O3S/c26-14-16-27-24(31)22-13-12-21(32-22)17-8-10-18(11-9-17)29-23(30)20-7-4-15-28-25(20)33-19-5-2-1-3-6-19/h1-13,15H,14,16,26H2,(H,27,31)(H,29,30)