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

Systemtic Name: 3-methyl-1-[2-methyl-4-[5-[(6-phenylpyridazin-3-yl)sulfanylmethyl]furan-2-yl]carbonyl-piperazin-1-yl]butan-1-one Openeye Name: 3-methyl-1-[2-methyl-4-[5-[(6-phenylpyridazin-3-yl)sulfanylmethyl]furan-2-carbonyl]piperazin-1-yl]butan-1-one CAS Name: 3-methyl-1-[2-methyl-4-[oxo-[5-[[(6-phenyl-3-pyridazinyl)thio]methyl]-2-furanyl]methyl]-1-piperazinyl]-1-butanone IUPAC Name: 3-methyl-1-[2-methyl-4-[5-[(6-phenylpyridazin-3-yl)sulfanylmethyl]furan-2-carbonyl]piperazin-1-yl]butan-1-one Traditional Name: 3-methyl-1-[2-methyl-4-[5-[[(6-phenylpyridazin-3-yl)thio]methyl]-2-furoyl]piperazino]butan-1-one Formula: C26H30N4O3S MolecularWeight: 478.6064

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CC(C)C)C(=O)C2=CC=C(O2)CSC3=NN=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1CN(CCN1C(=O)CC(C)C)C(=O)C2=CC=C(O2)CSC3=NN=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H30N4O3S/c1-18(2)15-25(31)30-14-13-29(16-19(30)3)26(32)23-11-9-21(33-23)17-34-24-12-10-22(27-28-24)20-7-5-4-6-8-20/h4-12,18-19H,13-17H2,1-3H3