3-cyclohexyl-2-cyclohexylimino-5-[(1-prop-2-ynylindol-3-yl)methylidene]-1,3-thiazolidin-4-one

Systemtic Name: 3-cyclohexyl-2-cyclohexylimino-5-[(1-prop-2-ynylindol-3-yl)methylidene]-1,3-thiazolidin-4-one Openeye Name: 3-cyclohexyl-2-cyclohexylimino-5-[(1-prop-2-ynylindol-3-yl)methylene]thiazolidin-4-one CAS Name: 3-cyclohexyl-2-cyclohexylimino-5-[(1-prop-2-ynyl-3-indolyl)methylidene]-4-thiazolidinone IUPAC Name: 3-cyclohexyl-2-cyclohexylimino-5-[(1-prop-2-ynylindol-3-yl)methylidene]-1,3-thiazolidin-4-one Traditional Name: 3-cyclohexyl-2-cyclohexylimino-5-[(1-propargylindol-3-yl)methylene]thiazolidin-4-one Formula: C27H31N3OS MolecularWeight: 445.61954

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C=C(C2=CC=CC=C21)C=C3C(=O)N(C(=NC4CCCCC4)S3)C5CCCCC5

Isomeric SMILES

C#CCN1C=C(C2=CC=CC=C21)C=C3C(=O)N(C(=NC4CCCCC4)S3)C5CCCCC5

InChI

InChI=1S/C27H31N3OS/c1-2-17-29-19-20(23-15-9-10-16-24(23)29)18-25-26(31)30(22-13-7-4-8-14-22)27(32-25)28-21-11-5-3-6-12-21/h1,9-10,15-16,18-19,21-22H,3-8,11-14,17H2