N-[3-[4-(1,2-benzothiazol-3-ylcarbonyl)piperazin-1-yl]carbonylphenyl]ethanamide

Systemtic Name: N-[3-[4-(1,2-benzothiazol-3-ylcarbonyl)piperazin-1-yl]carbonylphenyl]ethanamide Openeye Name: N-[3-[4-(1,2-benzothiazole-3-carbonyl)piperazine-1-carbonyl]phenyl]acetamide CAS Name: N-[3-[[4-[1,2-benzothiazol-3-yl(oxo)methyl]-1-piperazinyl]-oxomethyl]phenyl]acetamide IUPAC Name: N-[3-[4-(1,2-benzothiazole-3-carbonyl)piperazine-1-carbonyl]phenyl]acetamide Traditional Name: N-[3-[4-(1,2-benzothiazole-3-carbonyl)piperazine-1-carbonyl]phenyl]acetamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=NSC4=CC=CC=C43

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C21H20N4O3S/c1-14(26)22-16-6-4-5-15(13-16)20(27)24-9-11-25(12-10-24)21(28)19-17-7-2-3-8-18(17)29-23-19/h2-8,13H,9-12H2,1H3,(H,22,26)