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

Systemtic Name: 2-[(4-ethylphenyl)carbamothioyl-methyl-amino]-N-(4-morpholin-4-ylphenyl)ethanamide Openeye Name: 2-[(4-ethylphenyl)carbamothioyl-methyl-amino]-N-(4-morpholinophenyl)acetamide CAS Name: 2-[[(4-ethylanilino)-sulfanylidenemethyl]-methylamino]-N-[4-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-[(4-ethylphenyl)carbamothioyl-methylamino]-N-(4-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[(4-ethylphenyl)thiocarbamoyl-methyl-amino]-N-(4-morpholinophenyl)acetamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)N(C)CC(=O)NC2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)N(C)CC(=O)NC2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C22H28N4O2S/c1-3-17-4-6-19(7-5-17)24-22(29)25(2)16-21(27)23-18-8-10-20(11-9-18)26-12-14-28-15-13-26/h4-11H,3,12-16H2,1-2H3,(H,23,27)(H,24,29)