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

Systemtic Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-[2-(4-methoxyphenyl)chromen-4-ylidene]ethanenitrile Openeye Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-[2-(4-methoxyphenyl)chromen-4-ylidene]acetonitrile CAS Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-[2-(4-methoxyphenyl)-1-benzopyran-4-ylidene]acetonitrile IUPAC Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-[2-(4-methoxyphenyl)chromen-4-ylidene]acetonitrile Traditional Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-[2-(4-methoxyphenyl)chromen-4-ylidene]acetonitrile Formula: C25H16N2O2S MolecularWeight: 408.47174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=C(C#N)C3=NC4=CC=CC=C4S3)C5=CC=CC=C5O2

Isomeric SMILES

COC1=CC=C(C=C1)C2=C/C(=C(\C#N)/C3=NC4=CC=CC=C4S3)/C5=CC=CC=C5O2

InChI

InChI=1S/C25H16N2O2S/c1-28-17-12-10-16(11-13-17)23-14-19(18-6-2-4-8-22(18)29-23)20(15-26)25-27-21-7-3-5-9-24(21)30-25/h2-14H,1H3/b20-19-