4-(1,3-dithiolan-2-yl)-N-[2-methyl-5-(propanoylamino)phenyl]benzamide

Systemtic Name: 4-(1,3-dithiolan-2-yl)-N-[2-methyl-5-(propanoylamino)phenyl]benzamide Openeye Name: 4-(1,3-dithiolan-2-yl)-N-[2-methyl-5-(propanoylamino)phenyl]benzamide CAS Name: 4-(1,3-dithiolan-2-yl)-N-[2-methyl-5-(1-oxopropylamino)phenyl]benzamide IUPAC Name: 4-(1,3-dithiolan-2-yl)-N-[2-methyl-5-(propanoylamino)phenyl]benzamide Traditional Name: 4-(1,3-dithiolan-2-yl)-N-(2-methyl-5-propionamido-phenyl)benzamide Formula: C20H22N2O2S2 MolecularWeight: 386.53088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C2=CC=C(C=C2)C3SCCS3

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)C)NC(=O)C2=CC=C(C=C2)C3SCCS3

InChI

InChI=1S/C20H22N2O2S2/c1-3-18(23)21-16-9-4-13(2)17(12-16)22-19(24)14-5-7-15(8-6-14)20-25-10-11-26-20/h4-9,12,20H,3,10-11H2,1-2H3,(H,21,23)(H,22,24)