N-[6-(dimethylamino)pyridin-3-yl]-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-butanamide

Systemtic Name: N-[6-(dimethylamino)pyridin-3-yl]-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-butanamide Openeye Name: N-[6-(dimethylamino)-3-pyridyl]-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanyl-butanamide CAS Name: N-[6-(dimethylamino)-3-pyridinyl]-2-[(2-fluorophenyl)sulfonylamino]-4-(methylthio)butanamide IUPAC Name: N-[6-(dimethylamino)pyridin-3-yl]-2-[(2-fluorophenyl)sulfonylamino]-4-methylsulfanylbutanamide Traditional Name: N-[6-(dimethylamino)-3-pyridyl]-2-[(2-fluorophenyl)sulfonylamino]-4-(methylthio)butyramide Formula: C18H23FN4O3S2 MolecularWeight: 426.528623

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C(C=C1)NC(=O)C(CCSC)NS(=O)(=O)C2=CC=CC=C2F

Isomeric SMILES

CN(C)C1=NC=C(C=C1)NC(=O)C(CCSC)NS(=O)(=O)C2=CC=CC=C2F

InChI

InChI=1S/C18H23FN4O3S2/c1-23(2)17-9-8-13(12-20-17)21-18(24)15(10-11-27-3)22-28(25,26)16-7-5-4-6-14(16)19/h4-9,12,15,22H,10-11H2,1-3H3,(H,21,24)