N-[2-[(4-nitrophenyl)amino]ethyl]-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide

Systemtic Name: N-[2-[(4-nitrophenyl)amino]ethyl]-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide Openeye Name: N-[2-(4-nitroanilino)ethyl]-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propanamide CAS Name: N-[2-(4-nitroanilino)ethyl]-3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]propanamide IUPAC Name: N-[2-(4-nitroanilino)ethyl]-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanamide Traditional Name: N-[2-(4-nitroanilino)ethyl]-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propionamide Formula: C17H17N5O4S MolecularWeight: 387.41298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCCNC(=O)CCC2=NC(=NO2)C3=CSC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NCCNC(=O)CCC2=NC(=NO2)C3=CSC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O4S/c23-15(5-6-16-20-17(21-26-16)12-7-10-27-11-12)19-9-8-18-13-1-3-14(4-2-13)22(24)25/h1-4,7,10-11,18H,5-6,8-9H2,(H,19,23)