N-[(5-nitrothiophen-3-yl)methyl]-N'-quinolin-2-yl-propane-1,3-diamine

Systemtic Name: N-[(5-nitrothiophen-3-yl)methyl]-N'-quinolin-2-yl-propane-1,3-diamine Openeye Name: N-[(5-nitro-3-thienyl)methyl]-N'-(2-quinolyl)propane-1,3-diamine CAS Name: N-[(5-nitro-3-thiophenyl)methyl]-N'-(2-quinolinyl)propane-1,3-diamine IUPAC Name: N-[(5-nitrothiophen-3-yl)methyl]-N'-quinolin-2-ylpropane-1,3-diamine Traditional Name: (5-nitro-3-thienyl)methyl-[3-(2-quinolylamino)propyl]amine Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)NCCCNCC3=CSC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)NCCCNCC3=CSC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O2S/c22-21(23)17-10-13(12-24-17)11-18-8-3-9-19-16-7-6-14-4-1-2-5-15(14)20-16/h1-2,4-7,10,12,18H,3,8-9,11H2,(H,19,20)