2-[5-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butanoyl]thiophen-2-yl]-N-methyl-ethanamide

Systemtic Name: 2-[5-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butanoyl]thiophen-2-yl]-N-methyl-ethanamide Openeye Name: 2-[5-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butanoyl]-2-thienyl]-N-methyl-acetamide CAS Name: 2-[5-[4-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]-1-oxobutyl]-2-thiophenyl]-N-methylacetamide IUPAC Name: 2-[5-[4-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]butanoyl]thiophen-2-yl]-N-methylacetamide Traditional Name: 2-[5-[4-[4-(1,2-benzothiazol-3-yl)piperazino]butanoyl]-2-thienyl]-N-methyl-acetamide Formula: C22H26N4O2S2 MolecularWeight: 442.59744

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CC1=CC=C(S1)C(=O)CCCN2CCN(CC2)C3=NSC4=CC=CC=C43

Isomeric SMILES

CNC(=O)CC1=CC=C(S1)C(=O)CCCN2CCN(CC2)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C22H26N4O2S2/c1-23-21(28)15-16-8-9-20(29-16)18(27)6-4-10-25-11-13-26(14-12-25)22-17-5-2-3-7-19(17)30-24-22/h2-3,5,7-9H,4,6,10-15H2,1H3,(H,23,28)