2-(1-azanyl-3-methylsulfanyl-propyl)-N-[2-[(5-nitropyridin-2-yl)amino]ethyl]-1,3-oxazole-4-carboxamide

Systemtic Name: 2-(1-azanyl-3-methylsulfanyl-propyl)-N-[2-[(5-nitropyridin-2-yl)amino]ethyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-(1-amino-3-methylsulfanyl-propyl)-N-[2-[(5-nitro-2-pyridyl)amino]ethyl]oxazole-4-carboxamide CAS Name: 2-[1-amino-3-(methylthio)propyl]-N-[2-[(5-nitro-2-pyridinyl)amino]ethyl]-4-oxazolecarboxamide IUPAC Name: 2-(1-amino-3-methylsulfanylpropyl)-N-[2-[(5-nitropyridin-2-yl)amino]ethyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-[1-amino-3-(methylthio)propyl]-N-[2-[(5-nitro-2-pyridyl)amino]ethyl]oxazole-4-carboxamide Formula: C15H20N6O4S MolecularWeight: 380.4221

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC(=CO1)C(=O)NCCNC2=NC=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

CSCCC(C1=NC(=CO1)C(=O)NCCNC2=NC=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C15H20N6O4S/c1-26-7-4-11(16)15-20-12(9-25-15)14(22)18-6-5-17-13-3-2-10(8-19-13)21(23)24/h2-3,8-9,11H,4-7,16H2,1H3,(H,17,19)(H,18,22)