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

Systemtic Name: N-[2-(2-naphthalen-2-yl-2-oxidanylidene-ethyl)sulfanyl-1,3-benzothiazol-6-yl]-4-nitro-benzamide Openeye Name: N-[2-[2-(2-naphthyl)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-4-nitro-benzamide CAS Name: N-[2-[[2-(2-naphthalenyl)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]-4-nitrobenzamide IUPAC Name: N-[2-(2-naphthalen-2-yl-2-oxoethyl)sulfanyl-1,3-benzothiazol-6-yl]-4-nitrobenzamide Traditional Name: N-[2-[[2-keto-2-(2-naphthyl)ethyl]thio]-1,3-benzothiazol-6-yl]-4-nitro-benzamide Formula: C26H17N3O4S2 MolecularWeight: 499.56088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)CSC3=NC4=C(S3)C=C(C=C4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)CSC3=NC4=C(S3)C=C(C=C4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H17N3O4S2/c30-23(19-6-5-16-3-1-2-4-18(16)13-19)15-34-26-28-22-12-9-20(14-24(22)35-26)27-25(31)17-7-10-21(11-8-17)29(32)33/h1-14H,15H2,(H,27,31)