2-[3-(butanoylamino)phenyl]sulfanyl-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)butanamide

Systemtic Name: 2-[3-(butanoylamino)phenyl]sulfanyl-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)butanamide Openeye Name: 2-[3-(butanoylamino)phenyl]sulfanyl-N-(5-methyl-4-phenyl-thiazol-2-yl)butanamide CAS Name: N-(5-methyl-4-phenyl-2-thiazolyl)-2-[[3-(1-oxobutylamino)phenyl]thio]butanamide IUPAC Name: 2-[3-(butanoylamino)phenyl]sulfanyl-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)butanamide Traditional Name: 2-[(3-butyramidophenyl)thio]-N-(5-methyl-4-phenyl-thiazol-2-yl)butyramide Formula: C24H27N3O2S2 MolecularWeight: 453.62008

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)SC(CC)C(=O)NC2=NC(=C(S2)C)C3=CC=CC=C3

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)SC(CC)C(=O)NC2=NC(=C(S2)C)C3=CC=CC=C3

InChI

InChI=1S/C24H27N3O2S2/c1-4-10-21(28)25-18-13-9-14-19(15-18)31-20(5-2)23(29)27-24-26-22(16(3)30-24)17-11-7-6-8-12-17/h6-9,11-15,20H,4-5,10H2,1-3H3,(H,25,28)(H,26,27,29)