3-nitro-4-[2-oxidanylidene-2-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]ethyl]sulfanyl-benzamide

Systemtic Name: 3-nitro-4-[2-oxidanylidene-2-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]ethyl]sulfanyl-benzamide Openeye Name: 3-nitro-4-[2-oxo-2-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]ethyl]sulfanyl-benzamide CAS Name: 3-nitro-4-[[2-oxo-2-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]ethyl]thio]benzamide IUPAC Name: 3-nitro-4-[2-oxo-2-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]ethyl]sulfanylbenzamide Traditional Name: 4-[[2-keto-2-[(6-phenoxy-1,3-benzothiazol-2-yl)amino]ethyl]thio]-3-nitro-benzamide Formula: C22H16N4O5S2 MolecularWeight: 480.51624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC3=C(C=C2)N=C(S3)NC(=O)CSC4=C(C=C(C=C4)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC3=C(C=C2)N=C(S3)NC(=O)CSC4=C(C=C(C=C4)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O5S2/c23-21(28)13-6-9-18(17(10-13)26(29)30)32-12-20(27)25-22-24-16-8-7-15(11-19(16)33-22)31-14-4-2-1-3-5-14/h1-11H,12H2,(H2,23,28)(H,24,25,27)