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

Systemtic Name: 1-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-ethyl-urea Openeye Name: 1-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-ethyl-urea CAS Name: 1-[3-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]phenyl]-3-ethylurea IUPAC Name: 1-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-3-ethylurea Traditional Name: 1-[3-[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(=C1)CCN2CCN(CC2)C3=NSC4=CC=CC=C43

Isomeric SMILES

CCNC(=O)NC1=CC=CC(=C1)CCN2CCN(CC2)C3=NSC4=CC=CC=C43

InChI

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