2-(1,3-benzothiazol-2-yl)-3-oxidanylidene-3-(3,4,5-trimethoxyphenyl)propanenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-3-oxidanylidene-3-(3,4,5-trimethoxyphenyl)propanenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-3-oxo-3-(3,4,5-trimethoxyphenyl)propanenitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-3-oxo-3-(3,4,5-trimethoxyphenyl)propanenitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-3-oxo-3-(3,4,5-trimethoxyphenyl)propanenitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-3-keto-3-(3,4,5-trimethoxyphenyl)propionitrile Formula: C19H16N2O4S MolecularWeight: 368.40634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)C(C#N)C2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)C(C#N)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H16N2O4S/c1-23-14-8-11(9-15(24-2)18(14)25-3)17(22)12(10-20)19-21-13-6-4-5-7-16(13)26-19/h4-9,12H,1-3H3