2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-[2-(4-methylpiperazin-1-yl)phenyl]-3-phenyl-propanamide

Systemtic Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-[2-(4-methylpiperazin-1-yl)phenyl]-3-phenyl-propanamide Openeye Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-[2-(4-methylpiperazin-1-yl)phenyl]-3-phenyl-propanamide CAS Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-[2-(4-methyl-1-piperazinyl)phenyl]-3-phenylpropanamide IUPAC Name: 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-N-[2-(4-methylpiperazin-1-yl)phenyl]-3-phenylpropanamide Traditional Name: N-[2-(4-methylpiperazino)phenyl]-3-phenyl-2-(piazthiol-4-ylsulfonylamino)propionamide Formula: C26H28N6O3S2 MolecularWeight: 536.66892

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC=C2NC(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC=C2NC(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C26H28N6O3S2/c1-31-14-16-32(17-15-31)23-12-6-5-10-20(23)27-26(33)22(18-19-8-3-2-4-9-19)30-37(34,35)24-13-7-11-21-25(24)29-36-28-21/h2-13,22,30H,14-18H2,1H3,(H,27,33)