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

Systemtic Name: 2-(3-ethyl-8-methyl-quinolin-2-yl)sulfanyl-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]ethanone Openeye Name: 2-[(3-ethyl-8-methyl-2-quinolyl)sulfanyl]-1-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 2-[(3-ethyl-8-methyl-2-quinolinyl)thio]-1-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(3-ethyl-8-methylquinolin-2-yl)sulfanyl-1-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-[(3-ethyl-8-methyl-2-quinolyl)thio]-1-[4-(2-furoyl)piperazino]ethanone Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O3S/c1-3-17-14-18-7-4-6-16(2)21(18)24-22(17)30-15-20(27)25-9-11-26(12-10-25)23(28)19-8-5-13-29-19/h4-8,13-14H,3,9-12,15H2,1-2H3