2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-1-[4-(2-ethoxyphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-1-[4-(2-ethoxyphenyl)piperazin-1-yl]ethanone Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-1-[4-(2-ethoxyphenyl)piperazin-1-yl]ethanone CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-1-[4-(2-ethoxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-1-[4-(2-ethoxyphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-1-(4-o-phenetylpiperazino)ethanone Formula: C24H30N2O4S MolecularWeight: 442.571

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)CSCC3=C(C=CC(=C3)C(=O)C)OC

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)CSCC3=C(C=CC(=C3)C(=O)C)OC

InChI

InChI=1S/C24H30N2O4S/c1-4-30-23-8-6-5-7-21(23)25-11-13-26(14-12-25)24(28)17-31-16-20-15-19(18(2)27)9-10-22(20)29-3/h5-10,15H,4,11-14,16-17H2,1-3H3