3-azanyl-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]benzamide

Systemtic Name: 3-azanyl-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]benzamide Openeye Name: 3-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]benzamide CAS Name: 3-amino-N-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]butyl]benzamide IUPAC Name: 3-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]benzamide Traditional Name: 3-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazino]butyl]benzamide Formula: C22H27N5OS MolecularWeight: 409.54768

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCNC(=O)C2=CC(=CC=C2)N)C3=NSC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1CCCCNC(=O)C2=CC(=CC=C2)N)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C22H27N5OS/c23-18-7-5-6-17(16-18)22(28)24-10-3-4-11-26-12-14-27(15-13-26)21-19-8-1-2-9-20(19)29-25-21/h1-2,5-9,16H,3-4,10-15,23H2,(H,24,28)