2-chloranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[[3-(propylcarbamoyl)phenyl]amino]butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[[3-(propylcarbamoyl)phenyl]amino]butan-2-yl]benzamide Openeye Name: 2-chloro-N-[3-methylsulfanyl-1-[[3-(propylcarbamoyl)phenyl]carbamoyl]propyl]benzamide CAS Name: 2-chloro-N-[4-(methylthio)-1-oxo-1-[3-[oxo(propylamino)methyl]anilino]butan-2-yl]benzamide IUPAC Name: 2-chloro-N-[4-methylsulfanyl-1-oxo-1-[3-(propylcarbamoyl)anilino]butan-2-yl]benzamide Traditional Name: 2-chloro-N-[3-(methylthio)-1-[[3-(propylcarbamoyl)phenyl]carbamoyl]propyl]benzamide Formula: C22H26ClN3O3S MolecularWeight: 447.97814

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=CC=C1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CCCNC(=O)C1=CC(=CC=C1)NC(=O)C(CCSC)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C22H26ClN3O3S/c1-3-12-24-20(27)15-7-6-8-16(14-15)25-22(29)19(11-13-30-2)26-21(28)17-9-4-5-10-18(17)23/h4-10,14,19H,3,11-13H2,1-2H3,(H,24,27)(H,25,29)(H,26,28)