(3S)-3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]carbonyl-N,N-diethyl-piperidine-1-carboxamide

Systemtic Name: (3S)-3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]carbonyl-N,N-diethyl-piperidine-1-carboxamide Openeye Name: (3S)-3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazine-1-carbonyl]-N,N-diethyl-piperidine-1-carboxamide CAS Name: (3S)-3-[[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-oxomethyl]-N,N-diethyl-1-piperidinecarboxamide IUPAC Name: (3S)-3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazine-1-carbonyl]-N,N-diethylpiperidine-1-carboxamide Traditional Name: (3S)-N,N-diethyl-3-(4-piazthiol-4-ylsulfonylpiperazine-1-carbonyl)piperidine-1-carboxamide Formula: C21H30N6O4S2 MolecularWeight: 494.6307

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCCC(C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CCN(CC)C(=O)N1CCC[C@@H](C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C21H30N6O4S2/c1-3-24(4-2)21(29)26-10-6-7-16(15-26)20(28)25-11-13-27(14-12-25)33(30,31)18-9-5-8-17-19(18)23-32-22-17/h5,8-9,16H,3-4,6-7,10-15H2,1-2H3/t16-/m0/s1