N-(1-naphthalen-1-ylethyl)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide

Systemtic Name: N-(1-naphthalen-1-ylethyl)-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethanamide Openeye Name: N-[1-(1-naphthyl)ethyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide CAS Name: N-[1-(1-naphthalenyl)ethyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide IUPAC Name: N-(1-naphthalen-1-ylethyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide Traditional Name: N-[1-(1-naphthyl)ethyl]-2-(1,1,3-triketo-1,2-benzothiazol-2-yl)acetamide Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)CN3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)CN3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C21H18N2O4S/c1-14(16-11-6-8-15-7-2-3-9-17(15)16)22-20(24)13-23-21(25)18-10-4-5-12-19(18)28(23,26)27/h2-12,14H,13H2,1H3,(H,22,24)