N-(1,3-benzothiazol-2-yl)-3-nitro-N-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-nitro-N-[(2-oxidanylidenepyrrolidin-1-yl)methyl]benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-nitro-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-nitro-N-[(2-oxo-1-pyrrolidinyl)methyl]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-nitro-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-[(2-ketopyrrolidino)methyl]-3-nitro-benzamide Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CN(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)CN(C2=NC3=CC=CC=C3S2)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O4S/c24-17-9-4-10-21(17)12-22(19-20-15-7-1-2-8-16(15)28-19)18(25)13-5-3-6-14(11-13)23(26)27/h1-3,5-8,11H,4,9-10,12H2