2-(methylamino)-5-nitro-N-[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)pentyl]benzamide

Systemtic Name: 2-(methylamino)-5-nitro-N-[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)pentyl]benzamide Openeye Name: 2-(methylamino)-5-nitro-N-[5-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]pentyl]benzamide CAS Name: 2-(methylamino)-5-nitro-N-[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)pentyl]benzamide IUPAC Name: 2-(methylamino)-5-nitro-N-[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)pentyl]benzamide Traditional Name: 2-(methylamino)-5-nitro-N-[5-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]pentyl]benzamide Formula: C19H21N5O4S MolecularWeight: 415.46614

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NCCCCCC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NCCCCCC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C19H21N5O4S/c1-20-15-9-8-13(24(26)27)12-14(15)19(25)21-10-4-2-3-7-17-22-18(23-28-17)16-6-5-11-29-16/h5-6,8-9,11-12,20H,2-4,7,10H2,1H3,(H,21,25)