[6-chloranyl-2-(5-methylthiophen-2-yl)quinolin-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: [6-chloranyl-2-(5-methylthiophen-2-yl)quinolin-4-yl]-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[6-chloro-2-(5-methyl-2-thienyl)-4-quinolyl]methanone CAS Name: [6-chloro-2-(5-methyl-2-thiophenyl)-4-quinolinyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[6-chloro-2-(5-methylthiophen-2-yl)quinolin-4-yl]methanone Traditional Name: (4-benzylpiperazino)-[6-chloro-2-(5-methyl-2-thienyl)-4-quinolyl]methanone Formula: C26H24ClN3OS MolecularWeight: 462.00626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(S1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C26H24ClN3OS/c1-18-7-10-25(32-18)24-16-22(21-15-20(27)8-9-23(21)28-24)26(31)30-13-11-29(12-14-30)17-19-5-3-2-4-6-19/h2-10,15-16H,11-14,17H2,1H3