N-(2-azanylethyl)-3-(5-nitropyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(2-azanylethyl)-3-(5-nitropyridin-2-yl)sulfanyl-propanamide Openeye Name: N-(2-aminoethyl)-3-[(5-nitro-2-pyridyl)sulfanyl]propanamide CAS Name: N-(2-aminoethyl)-3-[(5-nitro-2-pyridinyl)thio]propanamide IUPAC Name: N-(2-aminoethyl)-3-(5-nitropyridin-2-yl)sulfanylpropanamide Traditional Name: N-(2-aminoethyl)-3-[(5-nitro-2-pyridyl)thio]propionamide Formula: C10H14N4O3S MolecularWeight: 270.30816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1[N+](=O)[O-])SCCC(=O)NCCN

Isomeric SMILES

C1=CC(=NC=C1[N+](=O)[O-])SCCC(=O)NCCN

InChI

InChI=1S/C10H14N4O3S/c11-4-5-12-9(15)3-6-18-10-2-1-8(7-13-10)14(16)17/h1-2,7H,3-6,11H2,(H,12,15)