N-(furan-2-ylmethyl)-2-[2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonylphenyl]sulfanyl-ethanamide

Systemtic Name: N-(furan-2-ylmethyl)-2-[2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbonylphenyl]sulfanyl-ethanamide Openeye Name: N-(2-furylmethyl)-2-[2-[4-(4-pyridylmethyl)piperazine-1-carbonyl]phenyl]sulfanyl-acetamide CAS Name: N-(2-furanylmethyl)-2-[[2-[oxo-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methyl]phenyl]thio]acetamide IUPAC Name: N-(furan-2-ylmethyl)-2-[2-[4-(pyridin-4-ylmethyl)piperazine-1-carbonyl]phenyl]sulfanylacetamide Traditional Name: N-(2-furfuryl)-2-[[2-[4-(4-pyridylmethyl)piperazine-1-carbonyl]phenyl]thio]acetamide Formula: C24H26N4O3S MolecularWeight: 450.55324

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC=CC=C3SCC(=O)NCC4=CC=CO4

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=CC=CC=C3SCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C24H26N4O3S/c29-23(26-16-20-4-3-15-31-20)18-32-22-6-2-1-5-21(22)24(30)28-13-11-27(12-14-28)17-19-7-9-25-10-8-19/h1-10,15H,11-14,16-18H2,(H,26,29)