N-[2-[2-[(4-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-naphthalen-1-yl-ethanamide

Systemtic Name: N-[2-[2-[(4-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-naphthalen-1-yl-ethanamide Openeye Name: N-[2-[2-(4-methoxy-2-nitro-anilino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-(1-naphthyl)acetamide CAS Name: N-[2-[[2-(4-methoxy-2-nitroanilino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]-2-(1-naphthalenyl)acetamide IUPAC Name: N-[2-[2-(4-methoxy-2-nitroanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-naphthalen-1-ylacetamide Traditional Name: N-[2-[[2-keto-2-(4-methoxy-2-nitro-anilino)ethyl]thio]-1,3-benzothiazol-6-yl]-2-(1-naphthyl)acetamide Formula: C28H22N4O5S2 MolecularWeight: 558.62808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)CC4=CC=CC5=CC=CC=C54)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)CC4=CC=CC5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C28H22N4O5S2/c1-37-20-10-12-22(24(15-20)32(35)36)30-27(34)16-38-28-31-23-11-9-19(14-25(23)39-28)29-26(33)13-18-7-4-6-17-5-2-3-8-21(17)18/h2-12,14-15H,13,16H2,1H3,(H,29,33)(H,30,34)