[4-(benzimidazol-1-ylmethyl)piperidin-1-yl]-(5-thiophen-2-yl-1H-pyrazol-3-yl)methanone

Systemtic Name: [4-(benzimidazol-1-ylmethyl)piperidin-1-yl]-(5-thiophen-2-yl-1H-pyrazol-3-yl)methanone Openeye Name: [4-(benzimidazol-1-ylmethyl)-1-piperidyl]-[5-(2-thienyl)-1H-pyrazol-3-yl]methanone CAS Name: [4-(1-benzimidazolylmethyl)-1-piperidinyl]-(5-thiophen-2-yl-1H-pyrazol-3-yl)methanone IUPAC Name: [4-(benzimidazol-1-ylmethyl)piperidin-1-yl]-(5-thiophen-2-yl-1H-pyrazol-3-yl)methanone Traditional Name: [4-(benzimidazol-1-ylmethyl)piperidino]-[5-(2-thienyl)-1H-pyrazol-3-yl]methanone Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C=NC3=CC=CC=C32)C(=O)C4=NNC(=C4)C5=CC=CS5

Isomeric SMILES

C1CN(CCC1CN2C=NC3=CC=CC=C32)C(=O)C4=NNC(=C4)C5=CC=CS5

InChI

InChI=1S/C21H21N5OS/c27-21(18-12-17(23-24-18)20-6-3-11-28-20)25-9-7-15(8-10-25)13-26-14-22-16-4-1-2-5-19(16)26/h1-6,11-12,14-15H,7-10,13H2,(H,23,24)