N-(2-azanyl-2-oxidanylidene-ethyl)-3-[3-(4-fluorophenyl)sulfanylpropanoylamino]benzamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-3-[3-(4-fluorophenyl)sulfanylpropanoylamino]benzamide Openeye Name: N-(2-amino-2-oxo-ethyl)-3-[3-(4-fluorophenyl)sulfanylpropanoylamino]benzamide CAS Name: N-(2-amino-2-oxoethyl)-3-[[3-[(4-fluorophenyl)thio]-1-oxopropyl]amino]benzamide IUPAC Name: N-(2-amino-2-oxoethyl)-3-[3-(4-fluorophenyl)sulfanylpropanoylamino]benzamide Traditional Name: N-(2-amino-2-keto-ethyl)-3-[3-[(4-fluorophenyl)thio]propanoylamino]benzamide Formula: C18H18FN3O3S MolecularWeight: 375.417223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCSC2=CC=C(C=C2)F)C(=O)NCC(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCSC2=CC=C(C=C2)F)C(=O)NCC(=O)N

InChI

InChI=1S/C18H18FN3O3S/c19-13-4-6-15(7-5-13)26-9-8-17(24)22-14-3-1-2-12(10-14)18(25)21-11-16(20)23/h1-7,10H,8-9,11H2,(H2,20,23)(H,21,25)(H,22,24)