N-[1-(phenylmethyl)piperidin-4-yl]-5-[(6-phenylpyridazin-3-yl)sulfanylmethyl]furan-2-carboxamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-4-yl]-5-[(6-phenylpyridazin-3-yl)sulfanylmethyl]furan-2-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-5-[(6-phenylpyridazin-3-yl)sulfanylmethyl]furan-2-carboxamide CAS Name: N-[1-(phenylmethyl)-4-piperidinyl]-5-[[(6-phenyl-3-pyridazinyl)thio]methyl]-2-furancarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-5-[(6-phenylpyridazin-3-yl)sulfanylmethyl]furan-2-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-5-[[(6-phenylpyridazin-3-yl)thio]methyl]-2-furamide Formula: C28H28N4O2S MolecularWeight: 484.61252

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=C(O2)CSC3=NN=C(C=C3)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=C(O2)CSC3=NN=C(C=C3)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C28H28N4O2S/c33-28(29-23-15-17-32(18-16-23)19-21-7-3-1-4-8-21)26-13-11-24(34-26)20-35-27-14-12-25(30-31-27)22-9-5-2-6-10-22/h1-14,23H,15-20H2,(H,29,33)