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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)C4=CC=CC=C4C)C5=CSC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)C4=CC=CC=C4C)C5=CSC=C5

InChI

InChI=1S/C26H25N3OS/c1-18-7-8-23-21(15-18)22(16-24(27-23)20-9-14-31-17-20)26(30)29-12-10-28(11-13-29)25-6-4-3-5-19(25)2/h3-9,14-17H,10-13H2,1-2H3