2-(3-ethyl-7,8-dimethyl-quinolin-2-yl)sulfanyl-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3-ethyl-7,8-dimethyl-quinolin-2-yl)sulfanyl-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]ethanone Openeye Name: 2-[(3-ethyl-7,8-dimethyl-2-quinolyl)sulfanyl]-1-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 2-[(3-ethyl-7,8-dimethyl-2-quinolinyl)thio]-1-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(3-ethyl-7,8-dimethylquinolin-2-yl)sulfanyl-1-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-[(3-ethyl-7,8-dimethyl-2-quinolyl)thio]-1-[4-(2-furoyl)piperazino]ethanone Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C(=C(C=CC2=C1)C)C)SCC(=O)N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CCC1=C(N=C2C(=C(C=CC2=C1)C)C)SCC(=O)N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C24H27N3O3S/c1-4-18-14-19-8-7-16(2)17(3)22(19)25-23(18)31-15-21(28)26-9-11-27(12-10-26)24(29)20-6-5-13-30-20/h5-8,13-14H,4,9-12,15H2,1-3H3