N-[3-[(2-chloranyl-4-nitro-phenyl)amino]propyl]-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[3-[(2-chloranyl-4-nitro-phenyl)amino]propyl]-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-[3-(2-chloro-4-nitro-anilino)propyl]-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-[3-(2-chloro-4-nitroanilino)propyl]-2-[(6-oxo-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-[3-(2-chloro-4-nitroanilino)propyl]-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-[3-(2-chloro-4-nitro-anilino)propyl]-2-[(6-keto-1H-pyrimidin-2-yl)thio]acetamide Formula: C15H16ClN5O4S MolecularWeight: 397.83664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)NCCCNC(=O)CSC2=NC=CC(=O)N2

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)NCCCNC(=O)CSC2=NC=CC(=O)N2

InChI

InChI=1S/C15H16ClN5O4S/c16-11-8-10(21(24)25)2-3-12(11)17-5-1-6-18-14(23)9-26-15-19-7-4-13(22)20-15/h2-4,7-8,17H,1,5-6,9H2,(H,18,23)(H,19,20,22)