2-cyclohexylidene-2-[4-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1,3-thiazol-2-yl]ethanenitrile

Systemtic Name: 2-cyclohexylidene-2-[4-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1,3-thiazol-2-yl]ethanenitrile Openeye Name: 2-cyclohexylidene-2-[4-[3-(2-oxopyrrolidin-1-yl)phenyl]thiazol-2-yl]acetonitrile CAS Name: 2-cyclohexylidene-2-[4-[3-(2-oxo-1-pyrrolidinyl)phenyl]-2-thiazolyl]acetonitrile IUPAC Name: 2-cyclohexylidene-2-[4-[3-(2-oxopyrrolidin-1-yl)phenyl]-1,3-thiazol-2-yl]acetonitrile Traditional Name: 2-cyclohexylidene-2-[4-[3-(2-ketopyrrolidino)phenyl]thiazol-2-yl]acetonitrile Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)N4CCCC4=O)CC1

Isomeric SMILES

C1CCC(=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)N4CCCC4=O)CC1

InChI

InChI=1S/C21H21N3OS/c22-13-18(15-6-2-1-3-7-15)21-23-19(14-26-21)16-8-4-9-17(12-16)24-11-5-10-20(24)25/h4,8-9,12,14H,1-3,5-7,10-11H2