4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(2-methylpropoxy)propyl]piperazine-1-carboxamide

Systemtic Name: 4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(2-methylpropoxy)propyl]piperazine-1-carboxamide Openeye Name: 4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-(3-isobutoxypropyl)piperazine-1-carboxamide CAS Name: 4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(2-methylpropoxy)propyl]-1-piperazinecarboxamide IUPAC Name: 4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(2-methylpropoxy)propyl]piperazine-1-carboxamide Traditional Name: N-(3-isobutoxypropyl)-4-piazthiol-4-ylsulfonyl-piperazine-1-carboxamide Formula: C18H27N5O4S2 MolecularWeight: 441.56808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCCCNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CC(C)COCCCNC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C18H27N5O4S2/c1-14(2)13-27-12-4-7-19-18(24)22-8-10-23(11-9-22)29(25,26)16-6-3-5-15-17(16)21-28-20-15/h3,5-6,14H,4,7-13H2,1-2H3,(H,19,24)