N-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl]-3-nitro-benzamide Formula: C16H12N4O4S MolecularWeight: 356.35588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O4S/c21-14(19-16-18-12-6-1-2-7-13(12)25-16)9-17-15(22)10-4-3-5-11(8-10)20(23)24/h1-8H,9H2,(H,17,22)(H,18,19,21)