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

Systemtic Name: N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: 4-isopropyl-N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide CAS Name: N-[[4-[(2-methyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[[4-(2-methylpropanoylamino)phenyl]carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: N-[[4-(isobutyrylamino)phenyl]thiocarbamoyl]-4-isopropyl-benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C(C)C

InChI

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