2-[[6-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[[6-[(5-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[6-[(5-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[6-[(5-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-1,3-benzothiazol-2-yl]thio]-N-phenethylacetamide IUPAC Name: 2-[[6-[(5-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-2-yl]sulfanyl]-N-phenethylacetamide Traditional Name: 2-[[6-[(6-keto-5-methoxy-cyclohexa-2,4-dien-1-ylidene)methylamino]-1,3-benzothiazol-2-yl]thio]-N-phenethyl-acetamide Formula: C25H23N3O3S2 MolecularWeight: 477.59842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=CNC2=CC3=C(C=C2)N=C(S3)SCC(=O)NCCC4=CC=CC=C4)C1=O

Isomeric SMILES

COC1=CC=CC(=CNC2=CC3=C(C=C2)N=C(S3)SCC(=O)NCCC4=CC=CC=C4)C1=O

InChI

InChI=1S/C25H23N3O3S2/c1-31-21-9-5-8-18(24(21)30)15-27-19-10-11-20-22(14-19)33-25(28-20)32-16-23(29)26-13-12-17-6-3-2-4-7-17/h2-11,14-15,27H,12-13,16H2,1H3,(H,26,29)