1-(4-methoxyphenyl)-2-[4-(8-thiophen-3-ylquinolin-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 1-(4-methoxyphenyl)-2-[4-(8-thiophen-3-ylquinolin-2-yl)piperazin-1-yl]ethanone Openeye Name: 1-(4-methoxyphenyl)-2-[4-[8-(3-thienyl)-2-quinolyl]piperazin-1-yl]ethanone CAS Name: 1-(4-methoxyphenyl)-2-[4-[8-(3-thiophenyl)-2-quinolinyl]-1-piperazinyl]ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-[4-(8-thiophen-3-ylquinolin-2-yl)piperazin-1-yl]ethanone Traditional Name: 1-(4-methoxyphenyl)-2-[4-[8-(3-thienyl)-2-quinolyl]piperazino]ethanone Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CN2CCN(CC2)C3=NC4=C(C=CC=C4C5=CSC=C5)C=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CN2CCN(CC2)C3=NC4=C(C=CC=C4C5=CSC=C5)C=C3

InChI

InChI=1S/C26H25N3O2S/c1-31-22-8-5-19(6-9-22)24(30)17-28-12-14-29(15-13-28)25-10-7-20-3-2-4-23(26(20)27-25)21-11-16-32-18-21/h2-11,16,18H,12-15,17H2,1H3