2-[[6-[(3-nitrophenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[6-[(3-nitrophenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[6-[(3-nitrophenyl)methyleneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[6-[(3-nitrophenyl)methylideneamino]-1,3-benzothiazol-2-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[6-[(3-nitrophenyl)methylideneamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[6-[(3-nitrobenzylidene)amino]-1,3-benzothiazol-2-yl]thio]-N-phenyl-acetamide Formula: C22H16N4O3S2 MolecularWeight: 448.51744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)N=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)N=CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O3S2/c27-21(24-16-6-2-1-3-7-16)14-30-22-25-19-10-9-17(12-20(19)31-22)23-13-15-5-4-8-18(11-15)26(28)29/h1-13H,14H2,(H,24,27)