3-(3,4-dimethylphenyl)sulfanyl-N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]propanamide

Systemtic Name: 3-(3,4-dimethylphenyl)sulfanyl-N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]propanamide Openeye Name: 3-(3,4-dimethylphenyl)sulfanyl-N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]propanamide CAS Name: 3-[(3,4-dimethylphenyl)thio]-N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]propanamide IUPAC Name: 3-(3,4-dimethylphenyl)sulfanyl-N-ethyl-N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]propanamide Traditional Name: 3-[(3,4-dimethylphenyl)thio]-N-ethyl-N-[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]propionamide Formula: C22H27FN2O2S MolecularWeight: 402.525383

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=C(C=C1)F)C(=O)CCSC2=CC(=C(C=C2)C)C

Isomeric SMILES

CCN(CC(=O)NCC1=CC=C(C=C1)F)C(=O)CCSC2=CC(=C(C=C2)C)C

InChI

InChI=1S/C22H27FN2O2S/c1-4-25(15-21(26)24-14-18-6-8-19(23)9-7-18)22(27)11-12-28-20-10-5-16(2)17(3)13-20/h5-10,13H,4,11-12,14-15H2,1-3H3,(H,24,26)