4-(1H-benzimidazol-2-ylmethyl)-N-(3,4-dimethylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-(1H-benzimidazol-2-ylmethyl)-N-(3,4-dimethylphenyl)piperazine-1-carboxamide Openeye Name: 4-(1H-benzimidazol-2-ylmethyl)-N-(3,4-dimethylphenyl)piperazine-1-carboxamide CAS Name: 4-(1H-benzimidazol-2-ylmethyl)-N-(3,4-dimethylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-(1H-benzimidazol-2-ylmethyl)-N-(3,4-dimethylphenyl)piperazine-1-carboxamide Traditional Name: 4-(1H-benzimidazol-2-ylmethyl)-N-(3,4-dimethylphenyl)piperazine-1-carboxamide Formula: C21H25N5O MolecularWeight: 363.4561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3)C

InChI

InChI=1S/C21H25N5O/c1-15-7-8-17(13-16(15)2)22-21(27)26-11-9-25(10-12-26)14-20-23-18-5-3-4-6-19(18)24-20/h3-8,13H,9-12,14H2,1-2H3,(H,22,27)(H,23,24)