3-(4-butylsulfanylphenyl)imino-1-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]indol-2-one

Systemtic Name: 3-(4-butylsulfanylphenyl)imino-1-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]indol-2-one Openeye Name: 3-(4-butylsulfanylphenyl)imino-1-[[4-[(E)-cinnamyl]piperazin-1-yl]methyl]indolin-2-one CAS Name: 3-[4-(butylthio)phenyl]imino-1-[[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methyl]-2-indolone IUPAC Name: 3-(4-butylsulfanylphenyl)imino-1-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methyl]indol-2-one Traditional Name: 3-[4-(butylthio)phenyl]imino-1-[[4-[(E)-cinnamyl]piperazino]methyl]oxindole Formula: C32H36N4OS MolecularWeight: 524.71944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)CN4CCN(CC4)CC=CC5=CC=CC=C5

Isomeric SMILES

CCCCSC1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)CN4CCN(CC4)C/C=C/C5=CC=CC=C5

InChI

InChI=1S/C32H36N4OS/c1-2-3-24-38-28-17-15-27(16-18-28)33-31-29-13-7-8-14-30(29)36(32(31)37)25-35-22-20-34(21-23-35)19-9-12-26-10-5-4-6-11-26/h4-18H,2-3,19-25H2,1H3/b12-9+,33-31?