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

Systemtic Name: N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]-4-(1,3-dithiolan-2-yl)benzamide Openeye Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-4-(1,3-dithiolan-2-yl)benzamide CAS Name: N-[[3-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]-4-(1,3-dithiolan-2-yl)benzamide IUPAC Name: N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]-4-(1,3-dithiolan-2-yl)benzamide Traditional Name: N-[3-(cyclopropanecarbonylamino)benzyl]-4-(1,3-dithiolan-2-yl)benzamide Formula: C21H22N2O2S2 MolecularWeight: 398.54158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)C3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)C3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C21H22N2O2S2/c24-19(15-6-8-17(9-7-15)21-26-10-11-27-21)22-13-14-2-1-3-18(12-14)23-20(25)16-4-5-16/h1-3,6-9,12,16,21H,4-5,10-11,13H2,(H,22,24)(H,23,25)