N-(3-phenylsulfanylpropyl)quinoline-2-carboxamide

Systemtic Name: N-(3-phenylsulfanylpropyl)quinoline-2-carboxamide Openeye Name: N-(3-phenylsulfanylpropyl)quinoline-2-carboxamide CAS Name: N-[3-(phenylthio)propyl]-2-quinolinecarboxamide IUPAC Name: N-(3-phenylsulfanylpropyl)quinoline-2-carboxamide Traditional Name: N-[3-(phenylthio)propyl]quinaldamide Formula: C19H18N2OS MolecularWeight: 322.42402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCNC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

C1=CC=C(C=C1)SCCCNC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C19H18N2OS/c22-19(18-12-11-15-7-4-5-10-17(15)21-18)20-13-6-14-23-16-8-2-1-3-9-16/h1-5,7-12H,6,13-14H2,(H,20,22)