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

Systemtic Name: 2-azanyl-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-methyl-benzamide Openeye Name: 2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-methyl-benzamide CAS Name: 2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]butyl]-3-methylbenzamide IUPAC Name: 2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butyl]-3-methylbenzamide Traditional Name: 2-amino-N-[4-[4-(1,2-benzothiazol-3-yl)piperazino]butyl]-3-methyl-benzamide Formula: C23H29N5OS MolecularWeight: 423.57426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1N)C(=O)NCCCCN2CCN(CC2)C3=NSC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC(=C1N)C(=O)NCCCCN2CCN(CC2)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C23H29N5OS/c1-17-7-6-9-19(21(17)24)23(29)25-11-4-5-12-27-13-15-28(16-14-27)22-18-8-2-3-10-20(18)30-26-22/h2-3,6-10H,4-5,11-16,24H2,1H3,(H,25,29)