[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-(4-phenethylpiperazin-1-yl)methanone

Systemtic Name: [4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-(4-phenethylpiperazin-1-yl)methanone Openeye Name: [4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-(4-phenethylpiperazin-1-yl)methanone CAS Name: [4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-(4-phenethyl-1-piperazinyl)methanone IUPAC Name: [4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-(4-phenethylpiperazin-1-yl)methanone Traditional Name: [4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-(4-phenethylpiperazino)methanone Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)C(=O)N4CCN(CC4)CCC5=CC=CC=C5

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)C(=O)N4CCN(CC4)CCC5=CC=CC=C5

InChI

InChI=1S/C28H31N3O3S/c32-28(30-21-19-29(20-22-30)18-16-23-7-2-1-3-8-23)25-12-14-26(15-13-25)35(33,34)31-17-6-10-24-9-4-5-11-27(24)31/h1-5,7-9,11-15H,6,10,16-22H2