1-[2-methyl-4-[5-[(6-phenylpyridazin-3-yl)sulfanylmethyl]furan-2-yl]carbonyl-piperazin-1-yl]propan-1-one

Systemtic Name: 1-[2-methyl-4-[5-[(6-phenylpyridazin-3-yl)sulfanylmethyl]furan-2-yl]carbonyl-piperazin-1-yl]propan-1-one Openeye Name: 1-[2-methyl-4-[5-[(6-phenylpyridazin-3-yl)sulfanylmethyl]furan-2-carbonyl]piperazin-1-yl]propan-1-one CAS Name: 1-[2-methyl-4-[oxo-[5-[[(6-phenyl-3-pyridazinyl)thio]methyl]-2-furanyl]methyl]-1-piperazinyl]-1-propanone IUPAC Name: 1-[2-methyl-4-[5-[(6-phenylpyridazin-3-yl)sulfanylmethyl]furan-2-carbonyl]piperazin-1-yl]propan-1-one Traditional Name: 1-[2-methyl-4-[5-[[(6-phenylpyridazin-3-yl)thio]methyl]-2-furoyl]piperazino]propan-1-one Formula: C24H26N4O3S MolecularWeight: 450.55324

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1C)C(=O)C2=CC=C(O2)CSC3=NN=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCC(=O)N1CCN(CC1C)C(=O)C2=CC=C(O2)CSC3=NN=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N4O3S/c1-3-23(29)28-14-13-27(15-17(28)2)24(30)21-11-9-19(31-21)16-32-22-12-10-20(25-26-22)18-7-5-4-6-8-18/h4-12,17H,3,13-16H2,1-2H3