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

Systemtic Name: (6-methyl-2-thiophen-3-yl-quinolin-4-yl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone Openeye Name: [4-[(E)-cinnamyl]piperazin-1-yl]-[6-methyl-2-(3-thienyl)-4-quinolyl]methanone CAS Name: [6-methyl-2-(3-thiophenyl)-4-quinolinyl]-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methanone IUPAC Name: (6-methyl-2-thiophen-3-ylquinolin-4-yl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone Traditional Name: [4-[(E)-cinnamyl]piperazino]-[6-methyl-2-(3-thienyl)-4-quinolyl]methanone Formula: C28H27N3OS MolecularWeight: 453.59848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H27N3OS/c1-21-9-10-26-24(18-21)25(19-27(29-26)23-11-17-33-20-23)28(32)31-15-13-30(14-16-31)12-5-8-22-6-3-2-4-7-22/h2-11,17-20H,12-16H2,1H3/b8-5+