N-(1,3-benzothiazol-2-yl)-4-[1,1-bis(oxidanylidene)thiolan-3-yl]carbonyl-piperazine-1-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-[1,1-bis(oxidanylidene)thiolan-3-yl]carbonyl-piperazine-1-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-(1,1-dioxothiolane-3-carbonyl)piperazine-1-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-[(1,1-dioxo-3-thiolanyl)-oxomethyl]-1-piperazinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-(1,1-dioxothiolane-3-carbonyl)piperazine-1-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-(1,1-diketothiolane-3-carbonyl)piperazine-1-carboxamide Formula: C17H20N4O4S2 MolecularWeight: 408.4951

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1C(=O)N2CCN(CC2)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CS(=O)(=O)CC1C(=O)N2CCN(CC2)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H20N4O4S2/c22-15(12-5-10-27(24,25)11-12)20-6-8-21(9-7-20)17(23)19-16-18-13-3-1-2-4-14(13)26-16/h1-4,12H,5-11H2,(H,18,19,23)