N,4-bis(2-ethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N,4-bis(2-ethoxyphenyl)piperazine-1-carbothioamide Openeye Name: N,4-bis(2-ethoxyphenyl)piperazine-1-carbothioamide CAS Name: N,4-bis(2-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N,4-bis(2-ethoxyphenyl)piperazine-1-carbothioamide Traditional Name: N,4-bis(o-phenetyl)piperazine-1-carbothioamide Formula: C21H27N3O2S MolecularWeight: 385.52298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)N2CCN(CC2)C3=CC=CC=C3OCC

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)N2CCN(CC2)C3=CC=CC=C3OCC

InChI

InChI=1S/C21H27N3O2S/c1-3-25-19-11-7-5-9-17(19)22-21(27)24-15-13-23(14-16-24)18-10-6-8-12-20(18)26-4-2/h5-12H,3-4,13-16H2,1-2H3,(H,22,27)