N-[2-[2-[(5-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-naphthalen-1-yl-ethanamide

Systemtic Name: N-[2-[2-[(5-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-naphthalen-1-yl-ethanamide Openeye Name: N-[2-[2-(5-chloro-2-methyl-anilino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-(1-naphthyl)acetamide CAS Name: N-[2-[[2-(5-chloro-2-methylanilino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]-2-(1-naphthalenyl)acetamide IUPAC Name: N-[2-[2-(5-chloro-2-methylanilino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]-2-naphthalen-1-ylacetamide Traditional Name: N-[2-[[2-(5-chloro-2-methyl-anilino)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]-2-(1-naphthyl)acetamide Formula: C28H22ClN3O2S2 MolecularWeight: 532.07618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H22ClN3O2S2/c1-17-9-10-20(29)14-24(17)31-27(34)16-35-28-32-23-12-11-21(15-25(23)36-28)30-26(33)13-19-7-4-6-18-5-2-3-8-22(18)19/h2-12,14-15H,13,16H2,1H3,(H,30,33)(H,31,34)