N-[3-[(2-chloranyl-4-nitro-phenyl)amino]propyl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[3-[(2-chloranyl-4-nitro-phenyl)amino]propyl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[3-(2-chloro-4-nitro-anilino)propyl]-2-phenylsulfanyl-acetamide CAS Name: N-[3-(2-chloro-4-nitroanilino)propyl]-2-(phenylthio)acetamide IUPAC Name: N-[3-(2-chloro-4-nitroanilino)propyl]-2-phenylsulfanylacetamide Traditional Name: N-[3-(2-chloro-4-nitro-anilino)propyl]-2-(phenylthio)acetamide Formula: C17H18ClN3O3S MolecularWeight: 379.86112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(=O)NCCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)SCC(=O)NCCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H18ClN3O3S/c18-15-11-13(21(23)24)7-8-16(15)19-9-4-10-20-17(22)12-25-14-5-2-1-3-6-14/h1-3,5-8,11,19H,4,9-10,12H2,(H,20,22)