1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(3-methylbutylamino)-3-oxidanylidene-propyl]piperidine-4-carboxamide

Systemtic Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(3-methylbutylamino)-3-oxidanylidene-propyl]piperidine-4-carboxamide Openeye Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(isopentylamino)-3-oxo-propyl]piperidine-4-carboxamide CAS Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(3-methylbutylamino)-3-oxopropyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[3-(3-methylbutylamino)-3-oxopropyl]piperidine-4-carboxamide Traditional Name: N-[3-(isoamylamino)-3-keto-propyl]-1-piazthiol-4-ylsulfonyl-isonipecotamide Formula: C20H29N5O4S2 MolecularWeight: 467.60536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CC(C)CCNC(=O)CCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C20H29N5O4S2/c1-14(2)6-10-21-18(26)7-11-22-20(27)15-8-12-25(13-9-15)31(28,29)17-5-3-4-16-19(17)24-30-23-16/h3-5,14-15H,6-13H2,1-2H3,(H,21,26)(H,22,27)