4-[[4-(quinolin-4-ylsulfanylmethyl)phenyl]methyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[[4-(quinolin-4-ylsulfanylmethyl)phenyl]methyl]piperazine-1-carbaldehyde Openeye Name: 4-[[4-(4-quinolylsulfanylmethyl)phenyl]methyl]piperazine-1-carbaldehyde CAS Name: 4-[[4-[(4-quinolinylthio)methyl]phenyl]methyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[[4-(quinolin-4-ylsulfanylmethyl)phenyl]methyl]piperazine-1-carbaldehyde Traditional Name: 4-[4-[(4-quinolylthio)methyl]benzyl]piperazine-1-carbaldehyde Formula: C22H23N3OS MolecularWeight: 377.50252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)CSC3=CC=NC4=CC=CC=C43)C=O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)CSC3=CC=NC4=CC=CC=C43)C=O

InChI

InChI=1S/C22H23N3OS/c26-17-25-13-11-24(12-14-25)15-18-5-7-19(8-6-18)16-27-22-9-10-23-21-4-2-1-3-20(21)22/h1-10,17H,11-16H2