2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]-N-pentan-3-yl-ethanamide

Systemtic Name: 2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]-N-pentan-3-yl-ethanamide Openeye Name: N-(1-ethylpropyl)-2-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazin-1-yl]acetamide CAS Name: 2-[4-[(3-methyl-8-quinolinyl)sulfonyl]-1-piperazinyl]-N-pentan-3-ylacetamide IUPAC Name: 2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]-N-pentan-3-ylacetamide Traditional Name: N-(1-ethylpropyl)-2-[4-[(3-methyl-8-quinolyl)sulfonyl]piperazino]acetamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC3=CC(=CN=C32)C

Isomeric SMILES

CCC(CC)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC3=CC(=CN=C32)C

InChI

InChI=1S/C21H30N4O3S/c1-4-18(5-2)23-20(26)15-24-9-11-25(12-10-24)29(27,28)19-8-6-7-17-13-16(3)14-22-21(17)19/h6-8,13-14,18H,4-5,9-12,15H2,1-3H3,(H,23,26)