N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-2,2-diphenoxy-ethanamide

Systemtic Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]-2,2-diphenoxy-ethanamide Openeye Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]-2,2-diphenoxy-acetamide CAS Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]-2,2-diphenoxyacetamide IUPAC Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]-2,2-diphenoxyacetamide Traditional Name: N-[(3Z)-3-(3H-1,3-benzothiazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]-2,2-diphenoxy-acetamide Formula: C27H20N2O4S MolecularWeight: 468.5237

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(C(=O)NC2=CC(=C3NC4=CC=CC=C4S3)C(=O)C=C2)OC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)OC(C(=O)NC2=C/C(=C/3\NC4=CC=CC=C4S3)/C(=O)C=C2)OC5=CC=CC=C5

InChI

InChI=1S/C27H20N2O4S/c30-23-16-15-18(17-21(23)26-29-22-13-7-8-14-24(22)34-26)28-25(31)27(32-19-9-3-1-4-10-19)33-20-11-5-2-6-12-20/h1-17,27,29H,(H,28,31)/b26-21-