4-[3-(3-nitrophenyl)-1,2,4-thiadiazol-5-yl]-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[3-(3-nitrophenyl)-1,2,4-thiadiazol-5-yl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[3-(3-nitrophenyl)-1,2,4-thiadiazol-5-yl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[3-(3-nitrophenyl)-1,2,4-thiadiazol-5-yl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[3-(3-nitrophenyl)-1,2,4-thiadiazol-5-yl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[3-(3-nitrophenyl)-1,2,4-thiadiazol-5-yl]-N-phenyl-piperazine-1-carboxamide Formula: C19H18N6O3S MolecularWeight: 410.44962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=NS2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC(=NS2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C19H18N6O3S/c26-18(20-15-6-2-1-3-7-15)23-9-11-24(12-10-23)19-21-17(22-29-19)14-5-4-8-16(13-14)25(27)28/h1-8,13H,9-12H2,(H,20,26)