3-[3,5-dimethyl-4-[3-oxidanylidene-3-(2-thiophen-2-ylpyrrolidin-1-yl)propyl]pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[3,5-dimethyl-4-[3-oxidanylidene-3-(2-thiophen-2-ylpyrrolidin-1-yl)propyl]pyrazol-1-yl]propanenitrile Openeye Name: 3-[3,5-dimethyl-4-[3-oxo-3-[2-(2-thienyl)pyrrolidin-1-yl]propyl]pyrazol-1-yl]propanenitrile CAS Name: 3-[3,5-dimethyl-4-[3-oxo-3-(2-thiophen-2-yl-1-pyrrolidinyl)propyl]-1-pyrazolyl]propanenitrile IUPAC Name: 3-[3,5-dimethyl-4-[3-oxo-3-(2-thiophen-2-ylpyrrolidin-1-yl)propyl]pyrazol-1-yl]propanenitrile Traditional Name: 3-[4-[3-keto-3-[2-(2-thienyl)pyrrolidino]propyl]-3,5-dimethyl-pyrazol-1-yl]propionitrile Formula: C19H24N4OS MolecularWeight: 356.48506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)N2CCCC2C3=CC=CS3

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)N2CCCC2C3=CC=CS3

InChI

InChI=1S/C19H24N4OS/c1-14-16(15(2)23(21-14)12-5-10-20)8-9-19(24)22-11-3-6-17(22)18-7-4-13-25-18/h4,7,13,17H,3,5-6,8-9,11-12H2,1-2H3