2-(3-methylsulfanylpropyl)-7-phenyl-quinoline-3,4-diamine

Systemtic Name: 2-(3-methylsulfanylpropyl)-7-phenyl-quinoline-3,4-diamine Openeye Name: 2-(3-methylsulfanylpropyl)-7-phenyl-quinoline-3,4-diamine CAS Name: 2-[3-(methylthio)propyl]-7-phenylquinoline-3,4-diamine IUPAC Name: 2-(3-methylsulfanylpropyl)-7-phenylquinoline-3,4-diamine Traditional Name: [3-amino-2-[3-(methylthio)propyl]-7-phenyl-4-quinolyl]amine Formula: C19H21N3S MolecularWeight: 323.45514

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCC1=NC2=C(C=CC(=C2)C3=CC=CC=C3)C(=C1N)N

Isomeric SMILES

CSCCCC1=NC2=C(C=CC(=C2)C3=CC=CC=C3)C(=C1N)N

InChI

InChI=1S/C19H21N3S/c1-23-11-5-8-16-19(21)18(20)15-10-9-14(12-17(15)22-16)13-6-3-2-4-7-13/h2-4,6-7,9-10,12H,5,8,11,21H2,1H3,(H2,20,22)