4-(1,2-benzothiazol-3-ylcarbonyl)-N-(2-ethylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-(1,2-benzothiazol-3-ylcarbonyl)-N-(2-ethylphenyl)piperazine-1-carboxamide Openeye Name: 4-(1,2-benzothiazole-3-carbonyl)-N-(2-ethylphenyl)piperazine-1-carboxamide CAS Name: 4-[1,2-benzothiazol-3-yl(oxo)methyl]-N-(2-ethylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-(1,2-benzothiazole-3-carbonyl)-N-(2-ethylphenyl)piperazine-1-carboxamide Traditional Name: 4-(1,2-benzothiazole-3-carbonyl)-N-(2-ethylphenyl)piperazine-1-carboxamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)N2CCN(CC2)C(=O)C3=NSC4=CC=CC=C43

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)N2CCN(CC2)C(=O)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C21H22N4O2S/c1-2-15-7-3-5-9-17(15)22-21(27)25-13-11-24(12-14-25)20(26)19-16-8-4-6-10-18(16)28-23-19/h3-10H,2,11-14H2,1H3,(H,22,27)