N-[(4-methoxyphenyl)methyl]-4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-1-carbothioamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Openeye Name: N-[(4-methoxyphenyl)methyl]-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbothioamide CAS Name: N-[(4-methoxyphenyl)methyl]-4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinecarbothioamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Traditional Name: 4-(2-keto-3H-benzimidazol-1-yl)-N-p-anisyl-piperidine-1-carbothioamide Formula: C21H24N4O2S MolecularWeight: 396.50586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H24N4O2S/c1-27-17-8-6-15(7-9-17)14-22-21(28)24-12-10-16(11-13-24)25-19-5-3-2-4-18(19)23-20(25)26/h2-9,16H,10-14H2,1H3,(H,22,28)(H,23,26)