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

Systemtic Name: N-[4-[5-(acetamidomethyl)furan-2-yl]-1,3-thiazol-2-yl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[4-[5-(acetamidomethyl)-2-furyl]thiazol-2-yl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[4-[5-(acetamidomethyl)-2-furanyl]-2-thiazolyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[4-[5-(acetamidomethyl)furan-2-yl]-1,3-thiazol-2-yl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[4-[5-(acetamidomethyl)-2-furyl]thiazol-2-yl]-1-(2-nitrophenyl)isonipecotamide Formula: C22H23N5O5S MolecularWeight: 469.51352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(O1)C2=CSC(=N2)NC(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC(=O)NCC1=CC=C(O1)C2=CSC(=N2)NC(=O)C3CCN(CC3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O5S/c1-14(28)23-12-16-6-7-20(32-16)17-13-33-22(24-17)25-21(29)15-8-10-26(11-9-15)18-4-2-3-5-19(18)27(30)31/h2-7,13,15H,8-12H2,1H3,(H,23,28)(H,24,25,29)