N-(2-acetamido-1,3-benzothiazol-5-yl)-4-nitro-benzamide

Systemtic Name: N-(2-acetamido-1,3-benzothiazol-5-yl)-4-nitro-benzamide Openeye Name: N-(2-acetamido-1,3-benzothiazol-5-yl)-4-nitro-benzamide CAS Name: N-(2-acetamido-1,3-benzothiazol-5-yl)-4-nitrobenzamide IUPAC Name: N-(2-acetamido-1,3-benzothiazol-5-yl)-4-nitrobenzamide Traditional Name: N-(2-acetamido-1,3-benzothiazol-5-yl)-4-nitro-benzamide Formula: C16H12N4O4S MolecularWeight: 356.35588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC2=C(S1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=NC2=C(S1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O4S/c1-9(21)17-16-19-13-8-11(4-7-14(13)25-16)18-15(22)10-2-5-12(6-3-10)20(23)24/h2-8H,1H3,(H,18,22)(H,17,19,21)