[4-(2,3-dimethylphenyl)piperazin-1-yl]-[2-(5-methylthiophen-2-yl)quinolin-4-yl]methanone

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[2-(5-methylthiophen-2-yl)quinolin-4-yl]methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[2-(5-methyl-2-thienyl)-4-quinolyl]methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[2-(5-methyl-2-thiophenyl)-4-quinolinyl]methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[2-(5-methylthiophen-2-yl)quinolin-4-yl]methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-[2-(5-methyl-2-thienyl)-4-quinolyl]methanone Formula: C27H27N3OS MolecularWeight: 441.58778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(S5)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(S5)C)C

InChI

InChI=1S/C27H27N3OS/c1-18-7-6-10-25(20(18)3)29-13-15-30(16-14-29)27(31)22-17-24(26-12-11-19(2)32-26)28-23-9-5-4-8-21(22)23/h4-12,17H,13-16H2,1-3H3