1-[2-azanyl-3-(1-benzothiophen-3-yl)propanoyl]-4-fluoranyl-pyrrolidine-2-carbonitrile

Systemtic Name: 1-[2-azanyl-3-(1-benzothiophen-3-yl)propanoyl]-4-fluoranyl-pyrrolidine-2-carbonitrile Openeye Name: 1-[2-amino-3-(benzothiophen-3-yl)propanoyl]-4-fluoro-pyrrolidine-2-carbonitrile CAS Name: 1-[2-amino-3-(1-benzothiophen-3-yl)-1-oxopropyl]-4-fluoro-2-pyrrolidinecarbonitrile IUPAC Name: 1-[2-amino-3-(1-benzothiophen-3-yl)propanoyl]-4-fluoropyrrolidine-2-carbonitrile Traditional Name: 1-[2-amino-3-(benzothiophen-3-yl)propanoyl]-4-fluoro-pyrrolidine-2-carbonitrile Formula: C16H16FN3OS MolecularWeight: 317.381143

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C#N)C(=O)C(CC2=CSC3=CC=CC=C32)N)F

Isomeric SMILES

C1C(CN(C1C#N)C(=O)C(CC2=CSC3=CC=CC=C32)N)F

InChI

InChI=1S/C16H16FN3OS/c17-11-6-12(7-18)20(8-11)16(21)14(19)5-10-9-22-15-4-2-1-3-13(10)15/h1-4,9,11-12,14H,5-6,8,19H2