2-[4-(4-phenoxybutanoyl)piperazin-1-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide

Systemtic Name: 2-[4-(4-phenoxybutanoyl)piperazin-1-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide Openeye Name: 2-[4-(4-phenoxybutanoyl)piperazin-1-yl]-N-(2-thienylmethyl)pyridine-3-carboxamide CAS Name: 2-[4-(1-oxo-4-phenoxybutyl)-1-piperazinyl]-N-(thiophen-2-ylmethyl)-3-pyridinecarboxamide IUPAC Name: 2-[4-(4-phenoxybutanoyl)piperazin-1-yl]-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide Traditional Name: 2-[4-(4-phenoxybutanoyl)piperazino]-N-(2-thenyl)nicotinamide Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=N2)C(=O)NCC3=CC=CS3)C(=O)CCCOC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=N2)C(=O)NCC3=CC=CS3)C(=O)CCCOC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O3S/c30-23(11-5-17-32-20-7-2-1-3-8-20)28-13-15-29(16-14-28)24-22(10-4-12-26-24)25(31)27-19-21-9-6-18-33-21/h1-4,6-10,12,18H,5,11,13-17,19H2,(H,27,31)