2-[methyl-[(2-methylphenyl)carbamothioyl]amino]-N-(4-morpholin-4-ylphenyl)ethanamide

Systemtic Name: 2-[methyl-[(2-methylphenyl)carbamothioyl]amino]-N-(4-morpholin-4-ylphenyl)ethanamide Openeye Name: 2-[methyl(o-tolylcarbamothioyl)amino]-N-(4-morpholinophenyl)acetamide CAS Name: 2-[methyl-[(2-methylanilino)-sulfanylidenemethyl]amino]-N-[4-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-[methyl-[(2-methylphenyl)carbamothioyl]amino]-N-(4-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[methyl(o-tolylthiocarbamoyl)amino]-N-(4-morpholinophenyl)acetamide Formula: C21H26N4O2S MolecularWeight: 398.52174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N(C)CC(=O)NC2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N(C)CC(=O)NC2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C21H26N4O2S/c1-16-5-3-4-6-19(16)23-21(28)24(2)15-20(26)22-17-7-9-18(10-8-17)25-11-13-27-14-12-25/h3-10H,11-15H2,1-2H3,(H,22,26)(H,23,28)