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

Systemtic Name: 3-(4-butylsulfanylphenyl)imino-1-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]indol-2-one Openeye Name: 3-(4-butylsulfanylphenyl)imino-1-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]indolin-2-one CAS Name: 3-[4-(butylthio)phenyl]imino-1-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-2-indolone IUPAC Name: 3-(4-butylsulfanylphenyl)imino-1-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]indol-2-one Traditional Name: 3-[4-(butylthio)phenyl]imino-1-[[4-(4-nitrophenyl)piperazino]methyl]oxindole Formula: C29H31N5O3S MolecularWeight: 529.65314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)CN4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CCCCSC1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)CN4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H31N5O3S/c1-2-3-20-38-25-14-8-22(9-15-25)30-28-26-6-4-5-7-27(26)33(29(28)35)21-31-16-18-32(19-17-31)23-10-12-24(13-11-23)34(36)37/h4-15H,2-3,16-21H2,1H3