[4-(2-ethoxyphenyl)piperazin-1-yl]-[2-(5-methylthiophen-2-yl)quinolin-4-yl]methanone

Systemtic Name: [4-(2-ethoxyphenyl)piperazin-1-yl]-[2-(5-methylthiophen-2-yl)quinolin-4-yl]methanone Openeye Name: [4-(2-ethoxyphenyl)piperazin-1-yl]-[2-(5-methyl-2-thienyl)-4-quinolyl]methanone CAS Name: [4-(2-ethoxyphenyl)-1-piperazinyl]-[2-(5-methyl-2-thiophenyl)-4-quinolinyl]methanone IUPAC Name: [4-(2-ethoxyphenyl)piperazin-1-yl]-[2-(5-methylthiophen-2-yl)quinolin-4-yl]methanone Traditional Name: [2-(5-methyl-2-thienyl)-4-quinolyl]-(4-o-phenetylpiperazino)methanone Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(S5)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(S5)C

InChI

InChI=1S/C27H27N3O2S/c1-3-32-25-11-7-6-10-24(25)29-14-16-30(17-15-29)27(31)21-18-23(26-13-12-19(2)33-26)28-22-9-5-4-8-20(21)22/h4-13,18H,3,14-17H2,1-2H3