N-[2-[(4-methylpiperazin-1-yl)methyl]-1-propyl-benzimidazol-5-yl]thiophene-2-carboxamide

Systemtic Name: N-[2-[(4-methylpiperazin-1-yl)methyl]-1-propyl-benzimidazol-5-yl]thiophene-2-carboxamide Openeye Name: N-[2-[(4-methylpiperazin-1-yl)methyl]-1-propyl-benzimidazol-5-yl]thiophene-2-carboxamide CAS Name: N-[2-[(4-methyl-1-piperazinyl)methyl]-1-propyl-5-benzimidazolyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[(4-methylpiperazin-1-yl)methyl]-1-propylbenzimidazol-5-yl]thiophene-2-carboxamide Traditional Name: N-[2-[(4-methylpiperazino)methyl]-1-propyl-benzimidazol-5-yl]thiophene-2-carboxamide Formula: C21H27N5OS MolecularWeight: 397.53698

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)NC(=O)C3=CC=CS3)N=C1CN4CCN(CC4)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)NC(=O)C3=CC=CS3)N=C1CN4CCN(CC4)C

InChI

InChI=1S/C21H27N5OS/c1-3-8-26-18-7-6-16(22-21(27)19-5-4-13-28-19)14-17(18)23-20(26)15-25-11-9-24(2)10-12-25/h4-7,13-14H,3,8-12,15H2,1-2H3,(H,22,27)