2-[3-(butanoylamino)phenyl]sulfanyl-N-(3,5-dimethylphenyl)butanamide

Systemtic Name: 2-[3-(butanoylamino)phenyl]sulfanyl-N-(3,5-dimethylphenyl)butanamide Openeye Name: 2-[3-(butanoylamino)phenyl]sulfanyl-N-(3,5-dimethylphenyl)butanamide CAS Name: N-(3,5-dimethylphenyl)-2-[[3-(1-oxobutylamino)phenyl]thio]butanamide IUPAC Name: 2-[3-(butanoylamino)phenyl]sulfanyl-N-(3,5-dimethylphenyl)butanamide Traditional Name: 2-[(3-butyramidophenyl)thio]-N-(3,5-dimethylphenyl)butyramide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)SC(CC)C(=O)NC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)SC(CC)C(=O)NC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C22H28N2O2S/c1-5-8-21(25)23-17-9-7-10-19(14-17)27-20(6-2)22(26)24-18-12-15(3)11-16(4)13-18/h7,9-14,20H,5-6,8H2,1-4H3,(H,23,25)(H,24,26)