4-[2-[3-(butanoylamino)phenyl]sulfanylbutanoylamino]benzamide

Systemtic Name: 4-[2-[3-(butanoylamino)phenyl]sulfanylbutanoylamino]benzamide Openeye Name: 4-[2-[3-(butanoylamino)phenyl]sulfanylbutanoylamino]benzamide CAS Name: 4-[[1-oxo-2-[[3-(1-oxobutylamino)phenyl]thio]butyl]amino]benzamide IUPAC Name: 4-[2-[3-(butanoylamino)phenyl]sulfanylbutanoylamino]benzamide Traditional Name: 4-[2-[(3-butyramidophenyl)thio]butanoylamino]benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O3S/c1-3-6-19(25)23-16-7-5-8-17(13-16)28-18(4-2)21(27)24-15-11-9-14(10-12-15)20(22)26/h5,7-13,18H,3-4,6H2,1-2H3,(H2,22,26)(H,23,25)(H,24,27)