6-ethoxy-2-(4-methylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)chromen-4-imine

Systemtic Name: 6-ethoxy-2-(4-methylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)chromen-4-imine Openeye Name: 6-ethoxy-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(p-tolyl)chromen-4-imine CAS Name: 6-ethoxy-2-(4-methylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-benzopyran-4-imine IUPAC Name: 6-ethoxy-2-(4-methylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)chromen-4-imine Traditional Name: (E)-[6-ethoxy-2-(p-tolyl)chromen-4-ylidene]-(6-mesyl-1,3-benzothiazol-2-yl)amine Formula: C26H22N2O4S2 MolecularWeight: 490.59388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC(=CC2=NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)C5=CC=C(C=C5)C

Isomeric SMILES

CCOC1=CC\2=C(C=C1)OC(=C/C2=N\C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)C5=CC=C(C=C5)C

InChI

InChI=1S/C26H22N2O4S2/c1-4-31-18-9-12-23-20(13-18)22(15-24(32-23)17-7-5-16(2)6-8-17)28-26-27-21-11-10-19(34(3,29)30)14-25(21)33-26/h5-15H,4H2,1-3H3/b28-22+