1-[[[2-[(4-nitrophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]amino]methylidene]naphthalen-2-one

Systemtic Name: 1-[[[2-[(4-nitrophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]amino]methylidene]naphthalen-2-one Openeye Name: 1-[[[2-[(4-nitrophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]amino]methylene]naphthalen-2-one CAS Name: 1-[[[2-[(4-nitrophenyl)methylthio]-1,3-benzothiazol-6-yl]amino]methylidene]-2-naphthalenone IUPAC Name: 1-[[[2-[(4-nitrophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]amino]methylidene]naphthalen-2-one Traditional Name: 1-[[[2-[(4-nitrobenzyl)thio]-1,3-benzothiazol-6-yl]amino]methylene]naphthalen-2-one Formula: C25H17N3O3S2 MolecularWeight: 471.55078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=O)C2=CNC3=CC4=C(C=C3)N=C(S4)SCC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=O)C2=CNC3=CC4=C(C=C3)N=C(S4)SCC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H17N3O3S2/c29-23-12-7-17-3-1-2-4-20(17)21(23)14-26-18-8-11-22-24(13-18)33-25(27-22)32-15-16-5-9-19(10-6-16)28(30)31/h1-14,26H,15H2