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

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbothioamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinecarbothioamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Traditional Name: N-[4-(dimethylamino)benzyl]-4-(2-keto-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N5OS/c1-25(2)17-9-7-16(8-10-17)15-23-22(29)26-13-11-18(12-14-26)27-20-6-4-3-5-19(20)24-21(27)28/h3-10,18H,11-15H2,1-2H3,(H,23,29)(H,24,28)