N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-4-(4-methylsulfanylphenyl)piperazine-1-carboxamide

Systemtic Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-4-(4-methylsulfanylphenyl)piperazine-1-carboxamide Openeye Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-4-(4-methylsulfanylphenyl)piperazine-1-carboxamide CAS Name: N-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]-4-[4-(methylthio)phenyl]-1-piperazinecarboxamide IUPAC Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-4-(4-methylsulfanylphenyl)piperazine-1-carboxamide Traditional Name: N-[4-methoxy-3-(4-methylpiperazino)phenyl]-4-[4-(methylthio)phenyl]piperazine-1-carboxamide Formula: C24H33N5O2S MolecularWeight: 455.61612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=CC(=C2)NC(=O)N3CCN(CC3)C4=CC=C(C=C4)SC)OC

Isomeric SMILES

CN1CCN(CC1)C2=C(C=CC(=C2)NC(=O)N3CCN(CC3)C4=CC=C(C=C4)SC)OC

InChI

InChI=1S/C24H33N5O2S/c1-26-10-12-28(13-11-26)22-18-19(4-9-23(22)31-2)25-24(30)29-16-14-27(15-17-29)20-5-7-21(32-3)8-6-20/h4-9,18H,10-17H2,1-3H3,(H,25,30)