3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-ethyl-cyclohexa-1,3-diene-1-carboxamide

Systemtic Name: 3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-ethyl-cyclohexa-1,3-diene-1-carboxamide Openeye Name: 3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-ethyl-cyclohexa-1,3-diene-1-carboxamide CAS Name: 3-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]-2-ethyl-1-cyclohexa-1,3-dienecarboxamide IUPAC Name: 3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-2-ethylcyclohexa-1,3-diene-1-carboxamide Traditional Name: 3-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]-2-ethyl-cyclohexa-1,3-diene-1-carboxamide Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(CCC=C1CCN2CCN(CC2)C3=NSC4=CC=CC=C43)C(=O)N

Isomeric SMILES

CCC1=C(CCC=C1CCN2CCN(CC2)C3=NSC4=CC=CC=C43)C(=O)N

InChI

InChI=1S/C22H28N4OS/c1-2-17-16(6-5-8-18(17)21(23)27)10-11-25-12-14-26(15-13-25)22-19-7-3-4-9-20(19)28-24-22/h3-4,6-7,9H,2,5,8,10-15H2,1H3,(H2,23,27)