N-(6-acetamido-1,3-benzothiazol-2-yl)-2-nitro-benzamide

Systemtic Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-nitro-benzamide Openeye Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-nitro-benzamide CAS Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-nitrobenzamide IUPAC Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-nitrobenzamide Traditional Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-nitro-benzamide Formula: C16H12N4O4S MolecularWeight: 356.35588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

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