N-(2-ethoxyphenyl)-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide

Systemtic Name: N-(2-ethoxyphenyl)-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide Openeye Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(2-ethoxyphenyl)piperazine-1-carboxamide CAS Name: N-(2-ethoxyphenyl)-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-1-piperazinecarboxamide IUPAC Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(2-ethoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-o-phenetyl-piperazine-1-carboxamide Formula: C22H25N5O2S MolecularWeight: 423.5312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)N2CCN(CC2)C3=NC(=NS3)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)N2CCN(CC2)C3=NC(=NS3)CC4=CC=CC=C4

InChI

InChI=1S/C22H25N5O2S/c1-2-29-19-11-7-6-10-18(19)23-21(28)26-12-14-27(15-13-26)22-24-20(25-30-22)16-17-8-4-3-5-9-17/h3-11H,2,12-16H2,1H3,(H,23,28)