N-(2-methoxy-4-nitro-phenyl)-4-[1-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]imidazol-2-yl]piperidine-1-carbothioamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-4-[1-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]imidazol-2-yl]piperidine-1-carbothioamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-4-[1-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]imidazol-2-yl]piperidine-1-carbothioamide CAS Name: N-(2-methoxy-4-nitrophenyl)-4-[1-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-2-imidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-4-[1-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]imidazol-2-yl]piperidine-1-carbothioamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)-4-[1-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]imidazol-2-yl]piperidine-1-carbothioamide Formula: C25H25N7O4S MolecularWeight: 519.5755

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)N2CCC(CC2)C3=NC=CN3CC4=NOC(=N4)C5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)N2CCC(CC2)C3=NC=CN3CC4=NOC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C25H25N7O4S/c1-35-21-15-19(32(33)34)7-8-20(21)27-25(37)30-12-9-17(10-13-30)23-26-11-14-31(23)16-22-28-24(36-29-22)18-5-3-2-4-6-18/h2-8,11,14-15,17H,9-10,12-13,16H2,1H3,(H,27,37)