(2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)butanamide

Systemtic Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)butanamide Openeye Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]butanamide CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]butanamide IUPAC Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)butanamide Traditional Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-3-methyl-N-[2-pyrrolidino-2-(2-thienyl)ethyl]butyramide Formula: C21H28FN3O3S2 MolecularWeight: 453.593723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC(C1=CC=CS1)N2CCCC2)NS(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC(C1=CC=CS1)N2CCCC2)NS(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H28FN3O3S2/c1-15(2)20(24-30(27,28)19-10-4-3-8-16(19)22)21(26)23-14-17(18-9-7-13-29-18)25-11-5-6-12-25/h3-4,7-10,13,15,17,20,24H,5-6,11-12,14H2,1-2H3,(H,23,26)/t17?,20-/m0/s1