3-nitro-N-[2-oxidanylidene-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]benzamide

Systemtic Name: 3-nitro-N-[2-oxidanylidene-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]benzamide Openeye Name: 3-nitro-N-[2-oxo-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]benzamide CAS Name: 3-nitro-N-[2-oxo-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]benzamide IUPAC Name: 3-nitro-N-[2-oxo-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]benzamide Traditional Name: N-[2-keto-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)ethyl]-3-nitro-benzamide Formula: C16H16N4O4S MolecularWeight: 360.38764

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O4S/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/h3-5,8H,1-2,6-7,9H2,(H,17,22)(H,18,19,21)