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

Systemtic Name: 2-methoxy-N-[2-(2-naphthalen-1-yl-2-oxidanylidene-ethyl)sulfanyl-1,3-benzothiazol-6-yl]benzamide Openeye Name: 2-methoxy-N-[2-[2-(1-naphthyl)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide CAS Name: 2-methoxy-N-[2-[[2-(1-naphthalenyl)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 2-methoxy-N-[2-(2-naphthalen-1-yl-2-oxoethyl)sulfanyl-1,3-benzothiazol-6-yl]benzamide Traditional Name: N-[2-[[2-keto-2-(1-naphthyl)ethyl]thio]-1,3-benzothiazol-6-yl]-2-methoxy-benzamide Formula: C27H20N2O3S2 MolecularWeight: 484.5893

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C27H20N2O3S2/c1-32-24-12-5-4-10-21(24)26(31)28-18-13-14-22-25(15-18)34-27(29-22)33-16-23(30)20-11-6-8-17-7-2-3-9-19(17)20/h2-15H,16H2,1H3,(H,28,31)