4-propan-2-yl-N-[[4-(propylcarbamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-propan-2-yl-N-[[4-(propylcarbamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 4-isopropyl-N-[[4-(propylcarbamoyl)phenyl]carbamothioyl]benzamide CAS Name: N-[[4-[oxo(propylamino)methyl]anilino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: 4-propan-2-yl-N-[[4-(propylcarbamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 4-isopropyl-N-[[4-(propylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C21H25N3O2S/c1-4-13-22-19(25)16-9-11-18(12-10-16)23-21(27)24-20(26)17-7-5-15(6-8-17)14(2)3/h5-12,14H,4,13H2,1-3H3,(H,22,25)(H2,23,24,26,27)