N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-1-(2-nitrophenyl)isonipecotamide Formula: C24H22N4O4S MolecularWeight: 462.52088

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C24H22N4O4S/c29-23(16-11-13-27(14-12-16)19-6-2-3-7-20(19)28(30)31)25-15-17-9-10-21(32-17)24-26-18-5-1-4-8-22(18)33-24/h1-10,16H,11-15H2,(H,25,29)