4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]-N-(2-methyl-5-nitro-phenyl)piperidine-1-carbothioamide

Systemtic Name: 4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]-N-(2-methyl-5-nitro-phenyl)piperidine-1-carbothioamide Openeye Name: 4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]-N-(2-methyl-5-nitro-phenyl)piperidine-1-carbothioamide CAS Name: 4-[1-[(4-methoxyphenyl)methyl]-2-imidazolyl]-N-(2-methyl-5-nitrophenyl)-1-piperidinecarbothioamide IUPAC Name: 4-[1-[(4-methoxyphenyl)methyl]imidazol-2-yl]-N-(2-methyl-5-nitrophenyl)piperidine-1-carbothioamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-4-(1-p-anisylimidazol-2-yl)piperidine-1-carbothioamide Formula: C24H27N5O3S MolecularWeight: 465.56788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)N2CCC(CC2)C3=NC=CN3CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)N2CCC(CC2)C3=NC=CN3CC4=CC=C(C=C4)OC

InChI

InChI=1S/C24H27N5O3S/c1-17-3-6-20(29(30)31)15-22(17)26-24(33)27-12-9-19(10-13-27)23-25-11-14-28(23)16-18-4-7-21(32-2)8-5-18/h3-8,11,14-15,19H,9-10,12-13,16H2,1-2H3,(H,26,33)