2-[2-[3-(pentanoylamino)phenyl]sulfanylbutanoylamino]benzamide

Systemtic Name: 2-[2-[3-(pentanoylamino)phenyl]sulfanylbutanoylamino]benzamide Openeye Name: 2-[2-[3-(pentanoylamino)phenyl]sulfanylbutanoylamino]benzamide CAS Name: 2-[[1-oxo-2-[[3-(1-oxopentylamino)phenyl]thio]butyl]amino]benzamide IUPAC Name: 2-[2-[3-(pentanoylamino)phenyl]sulfanylbutanoylamino]benzamide Traditional Name: 2-[2-[[3-(valerylamino)phenyl]thio]butanoylamino]benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=CC=C1)SC(CC)C(=O)NC2=CC=CC=C2C(=O)N

Isomeric SMILES

CCCCC(=O)NC1=CC(=CC=C1)SC(CC)C(=O)NC2=CC=CC=C2C(=O)N

InChI

InChI=1S/C22H27N3O3S/c1-3-5-13-20(26)24-15-9-8-10-16(14-15)29-19(4-2)22(28)25-18-12-7-6-11-17(18)21(23)27/h6-12,14,19H,3-5,13H2,1-2H3,(H2,23,27)(H,24,26)(H,25,28)