N-[(4-morpholin-4-ylphenyl)carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[(4-morpholin-4-ylphenyl)carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: 4-isopropyl-N-[(4-morpholinophenyl)carbamothioyl]benzamide CAS Name: N-[[4-(4-morpholinyl)anilino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[(4-morpholin-4-ylphenyl)carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: 4-isopropyl-N-[(4-morpholinophenyl)thiocarbamoyl]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)N3CCOCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C21H25N3O2S/c1-15(2)16-3-5-17(6-4-16)20(25)23-21(27)22-18-7-9-19(10-8-18)24-11-13-26-14-12-24/h3-10,15H,11-14H2,1-2H3,(H2,22,23,25,27)