(6-methyl-2-thiophen-3-yl-quinolin-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (6-methyl-2-thiophen-3-yl-quinolin-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[6-methyl-2-(3-thienyl)-4-quinolyl]methanone CAS Name: [6-methyl-2-(3-thiophenyl)-4-quinolinyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(6-methyl-2-thiophen-3-ylquinolin-4-yl)methanone Traditional Name: (4-benzylpiperazino)-[6-methyl-2-(3-thienyl)-4-quinolyl]methanone Formula: C26H25N3OS MolecularWeight: 427.5612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CSC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CSC=C5

InChI

InChI=1S/C26H25N3OS/c1-19-7-8-24-22(15-19)23(16-25(27-24)21-9-14-31-18-21)26(30)29-12-10-28(11-13-29)17-20-5-3-2-4-6-20/h2-9,14-16,18H,10-13,17H2,1H3