2-(5-methylsulfanylpentyl)-3-nitro-quinolin-4-amine

Systemtic Name: 2-(5-methylsulfanylpentyl)-3-nitro-quinolin-4-amine Openeye Name: 2-(5-methylsulfanylpentyl)-3-nitro-quinolin-4-amine CAS Name: 2-[5-(methylthio)pentyl]-3-nitro-4-quinolinamine IUPAC Name: 2-(5-methylsulfanylpentyl)-3-nitroquinolin-4-amine Traditional Name: [2-[5-(methylthio)pentyl]-3-nitro-4-quinolyl]amine Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCCCC1=NC2=CC=CC=C2C(=C1[N+](=O)[O-])N

Isomeric SMILES

CSCCCCCC1=NC2=CC=CC=C2C(=C1[N+](=O)[O-])N

InChI

InChI=1S/C15H19N3O2S/c1-21-10-6-2-3-9-13-15(18(19)20)14(16)11-7-4-5-8-12(11)17-13/h4-5,7-8H,2-3,6,9-10H2,1H3,(H2,16,17)