2,4-bis(oxidanylidene)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide

Systemtic Name: 2,4-bis(oxidanylidene)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Openeye Name: 2,4-dioxo-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide CAS Name: 2,4-dioxo-N-[2-(1-pyrrolidinyl)-1,3-benzothiazol-6-yl]-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide IUPAC Name: 2,4-dioxo-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Traditional Name: 2,4-diketo-N-(2-pyrrolidino-1,3-benzothiazol-6-yl)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Formula: C20H19N5O4S2 MolecularWeight: 457.52596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=C(S2)C=C(C=C3)NS(=O)(=O)C4=CC5=C(C=C4)NC(=O)CC(=O)N5

Isomeric SMILES

C1CCN(C1)C2=NC3=C(S2)C=C(C=C3)NS(=O)(=O)C4=CC5=C(C=C4)NC(=O)CC(=O)N5

InChI

InChI=1S/C20H19N5O4S2/c26-18-11-19(27)22-16-10-13(4-6-14(16)21-18)31(28,29)24-12-3-5-15-17(9-12)30-20(23-15)25-7-1-2-8-25/h3-6,9-10,24H,1-2,7-8,11H2,(H,21,26)(H,22,27)