(2S)-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-N-pyridin-4-yl-butanamide

Systemtic Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-N-pyridin-4-yl-butanamide Openeye Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-N-(4-pyridyl)butanamide CAS Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-4-(methylthio)-N-pyridin-4-ylbutanamide IUPAC Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-N-pyridin-4-ylbutanamide Traditional Name: (2S)-2-[(2-fluorophenyl)sulfonylamino]-4-(methylthio)-N-(4-pyridyl)butyramide Formula: C16H18FN3O3S2 MolecularWeight: 383.460823

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=NC=C1)NS(=O)(=O)C2=CC=CC=C2F

Isomeric SMILES

CSCC[C@@H](C(=O)NC1=CC=NC=C1)NS(=O)(=O)C2=CC=CC=C2F

InChI

InChI=1S/C16H18FN3O3S2/c1-24-11-8-14(16(21)19-12-6-9-18-10-7-12)20-25(22,23)15-5-3-2-4-13(15)17/h2-7,9-10,14,20H,8,11H2,1H3,(H,18,19,21)/t14-/m0/s1