2-(5-phenylsulfanylpentyl)quinoline-3,4-diamine

Systemtic Name: 2-(5-phenylsulfanylpentyl)quinoline-3,4-diamine Openeye Name: 2-(5-phenylsulfanylpentyl)quinoline-3,4-diamine CAS Name: 2-[5-(phenylthio)pentyl]quinoline-3,4-diamine IUPAC Name: 2-(5-phenylsulfanylpentyl)quinoline-3,4-diamine Traditional Name: [3-amino-2-[5-(phenylthio)pentyl]-4-quinolyl]amine Formula: C20H23N3S MolecularWeight: 337.48172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCCCC2=NC3=CC=CC=C3C(=C2N)N

Isomeric SMILES

C1=CC=C(C=C1)SCCCCCC2=NC3=CC=CC=C3C(=C2N)N

InChI

InChI=1S/C20H23N3S/c21-19-16-11-6-7-12-17(16)23-18(20(19)22)13-5-2-8-14-24-15-9-3-1-4-10-15/h1,3-4,6-7,9-12H,2,5,8,13-14,22H2,(H2,21,23)