N-(1-azanyl-3-heptan-4-ylsulfonyl-1-oxidanylidene-propan-2-yl)-3-fluoranyl-benzamide hydrochloride

Systemtic Name: N-(1-azanyl-3-heptan-4-ylsulfonyl-1-oxidanylidene-propan-2-yl)-3-fluoranyl-benzamide hydrochloride Openeye Name: N-[2-amino-2-oxo-1-(1-propylbutylsulfonylmethyl)ethyl]-3-fluoro-benzamide hydrochloride CAS Name: N-(1-amino-3-heptan-4-ylsulfonyl-1-oxopropan-2-yl)-3-fluorobenzamide hydrochloride IUPAC Name: N-(1-amino-3-heptan-4-ylsulfonyl-1-oxopropan-2-yl)-3-fluorobenzamide hydrochloride Traditional Name: N-[2-amino-2-keto-1-(1-propylbutylsulfonylmethyl)ethyl]-3-fluoro-benzamide hydrochloride Formula: C17H26ClFN2O4S MolecularWeight: 408.915743

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)S(=O)(=O)CC(C(=O)N)NC(=O)C1=CC(=CC=C1)F.Cl

Isomeric SMILES

CCCC(CCC)S(=O)(=O)CC(C(=O)N)NC(=O)C1=CC(=CC=C1)F.Cl

InChI

InChI=1S/C17H25FN2O4S.ClH/c1-3-6-14(7-4-2)25(23,24)11-15(16(19)21)20-17(22)12-8-5-9-13(18)10-12;/h5,8-10,14-15H,3-4,6-7,11H2,1-2H3,(H2,19,21)(H,20,22);1H