1-[2-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-ethyl-urea

Systemtic Name: 1-[2-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-ethyl-urea Openeye Name: 1-[2-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-ethyl-urea CAS Name: 1-[2-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]phenyl]-3-ethylurea IUPAC Name: 1-[2-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-ethylurea Traditional Name: 1-[2-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]phenyl]-3-ethyl-urea Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=CC=CC=C1CCN2CCN(CC2)C3=NSC4=CC=CC=C43

Isomeric SMILES

CCNC(=O)NC1=CC=CC=C1CCN2CCN(CC2)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C22H27N5OS/c1-2-23-22(28)24-19-9-5-3-7-17(19)11-12-26-13-15-27(16-14-26)21-18-8-4-6-10-20(18)29-25-21/h3-10H,2,11-16H2,1H3,(H2,23,24,28)