(2Z)-2-[(5Z)-5-[(2-ethyl-1-benzofuran-3-yl)methylidene]-3-methyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-3-oxidanylidene-3-pyrrolidin-1-yl-propanenitrile

Systemtic Name: (2Z)-2-[(5Z)-5-[(2-ethyl-1-benzofuran-3-yl)methylidene]-3-methyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-3-oxidanylidene-3-pyrrolidin-1-yl-propanenitrile Openeye Name: (2Z)-2-[(5Z)-5-[(2-ethylbenzofuran-3-yl)methylene]-3-methyl-4-oxo-thiazolidin-2-ylidene]-3-oxo-3-pyrrolidin-1-yl-propanenitrile CAS Name: (2Z)-2-[(5Z)-5-[(2-ethyl-3-benzofuranyl)methylidene]-3-methyl-4-oxo-2-thiazolidinylidene]-3-oxo-3-(1-pyrrolidinyl)propanenitrile IUPAC Name: (2Z)-2-[(5Z)-5-[(2-ethyl-1-benzofuran-3-yl)methylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]-3-oxo-3-pyrrolidin-1-ylpropanenitrile Traditional Name: (2Z)-2-[(5Z)-5-[(2-ethylbenzofuran-3-yl)methylene]-4-keto-3-methyl-thiazolidin-2-ylidene]-3-keto-3-pyrrolidino-propionitrile Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C=C3C(=O)N(C(=C(C#N)C(=O)N4CCCC4)S3)C

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)/C=C\3/C(=O)N(/C(=C(\C#N)/C(=O)N4CCCC4)/S3)C

InChI

InChI=1S/C22H21N3O3S/c1-3-17-15(14-8-4-5-9-18(14)28-17)12-19-21(27)24(2)22(29-19)16(13-23)20(26)25-10-6-7-11-25/h4-5,8-9,12H,3,6-7,10-11H2,1-2H3/b19-12-,22-16-