2-cyclopentylidene-2-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanenitrile

Systemtic Name: 2-cyclopentylidene-2-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]ethanenitrile Openeye Name: 2-cyclopentylidene-2-[4-(4-pyrrolidin-1-ylsulfonylphenyl)thiazol-2-yl]acetonitrile CAS Name: 2-cyclopentylidene-2-[4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiazolyl]acetonitrile IUPAC Name: 2-cyclopentylidene-2-[4-(4-pyrrolidin-1-ylsulfonylphenyl)-1,3-thiazol-2-yl]acetonitrile Traditional Name: 2-cyclopentylidene-2-[4-(4-pyrrolidinosulfonylphenyl)thiazol-2-yl]acetonitrile Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C1

Isomeric SMILES

C1CCC(=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C1

InChI

InChI=1S/C20H21N3O2S2/c21-13-18(15-5-1-2-6-15)20-22-19(14-26-20)16-7-9-17(10-8-16)27(24,25)23-11-3-4-12-23/h7-10,14H,1-6,11-12H2