1-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-(4-nitrophenyl)sulfanyl-ethanone

Systemtic Name: 1-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-(4-nitrophenyl)sulfanyl-ethanone Openeye Name: 1-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-(4-nitrophenyl)sulfanyl-ethanone CAS Name: 1-[4-(2-ethoxyphenyl)-1-piperazinyl]-2-[(4-nitrophenyl)thio]ethanone IUPAC Name: 1-[4-(2-ethoxyphenyl)piperazin-1-yl]-2-(4-nitrophenyl)sulfanylethanone Traditional Name: 2-[(4-nitrophenyl)thio]-1-(4-o-phenetylpiperazino)ethanone Formula: C20H23N3O4S MolecularWeight: 401.47932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O4S/c1-2-27-19-6-4-3-5-18(19)21-11-13-22(14-12-21)20(24)15-28-17-9-7-16(8-10-17)23(25)26/h3-10H,2,11-15H2,1H3