2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(4-piperidin-1-ylphenyl)benzamide

Systemtic Name: 2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(4-piperidin-1-ylphenyl)benzamide Openeye Name: 2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-N-[4-(1-piperidyl)phenyl]benzamide CAS Name: 2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-N-[4-(1-piperidinyl)phenyl]benzamide IUPAC Name: 2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-N-(4-piperidin-1-ylphenyl)benzamide Traditional Name: 2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]-N-(4-piperidinophenyl)benzamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC(=O)NCC4=CC=CO4

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3SCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C25H27N3O3S/c29-24(26-17-21-7-6-16-31-21)18-32-23-9-3-2-8-22(23)25(30)27-19-10-12-20(13-11-19)28-14-4-1-5-15-28/h2-3,6-13,16H,1,4-5,14-15,17-18H2,(H,26,29)(H,27,30)