N-(1,3-benzothiazol-2-yl)-2-(3,4-dimethoxyphenyl)-6-methoxy-chromen-4-imine

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(3,4-dimethoxyphenyl)-6-methoxy-chromen-4-imine Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(3,4-dimethoxyphenyl)-6-methoxy-chromen-4-imine CAS Name: N-(1,3-benzothiazol-2-yl)-2-(3,4-dimethoxyphenyl)-6-methoxy-1-benzopyran-4-imine IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(3,4-dimethoxyphenyl)-6-methoxychromen-4-imine Traditional Name: (E)-1,3-benzothiazol-2-yl-[2-(3,4-dimethoxyphenyl)-6-methoxy-chromen-4-ylidene]amine Formula: C25H20N2O4S MolecularWeight: 444.5023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=CC2=NC3=NC4=CC=CC=C4S3)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

COC1=CC\2=C(C=C1)OC(=C/C2=N\C3=NC4=CC=CC=C4S3)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C25H20N2O4S/c1-28-16-9-11-20-17(13-16)19(27-25-26-18-6-4-5-7-24(18)32-25)14-22(31-20)15-8-10-21(29-2)23(12-15)30-3/h4-14H,1-3H3/b27-19+