(2E)-2-(1,3-benzothiazol-2-yl)-2-[2-(4-methoxyphenyl)-6-methyl-chromen-4-ylidene]ethanenitrile

Systemtic Name: (2E)-2-(1,3-benzothiazol-2-yl)-2-[2-(4-methoxyphenyl)-6-methyl-chromen-4-ylidene]ethanenitrile Openeye Name: (2E)-2-(1,3-benzothiazol-2-yl)-2-[2-(4-methoxyphenyl)-6-methyl-chromen-4-ylidene]acetonitrile CAS Name: (2E)-2-(1,3-benzothiazol-2-yl)-2-[2-(4-methoxyphenyl)-6-methyl-1-benzopyran-4-ylidene]acetonitrile IUPAC Name: (2E)-2-(1,3-benzothiazol-2-yl)-2-[2-(4-methoxyphenyl)-6-methylchromen-4-ylidene]acetonitrile Traditional Name: (2E)-2-(1,3-benzothiazol-2-yl)-2-[2-(4-methoxyphenyl)-6-methyl-chromen-4-ylidene]acetonitrile Formula: C26H18N2O2S MolecularWeight: 422.49832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=CC2=C(C#N)C3=NC4=CC=CC=C4S3)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC\2=C(C=C1)OC(=C/C2=C(/C#N)\C3=NC4=CC=CC=C4S3)C5=CC=C(C=C5)OC

InChI

InChI=1S/C26H18N2O2S/c1-16-7-12-23-20(13-16)19(14-24(30-23)17-8-10-18(29-2)11-9-17)21(15-27)26-28-22-5-3-4-6-25(22)31-26/h3-14H,1-2H3/b21-19+