N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]carbamothioyl]-3-ethoxy-benzamide

Systemtic Name: N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]carbamothioyl]-3-ethoxy-benzamide Openeye Name: N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]carbamothioyl]-3-ethoxy-benzamide CAS Name: N-[[4-[(2-diethylaminoethylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-3-ethoxybenzamide IUPAC Name: N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]carbamothioyl]-3-ethoxybenzamide Traditional Name: N-[[4-(2-diethylaminoethylcarbamoyl)phenyl]thiocarbamoyl]-3-ethoxy-benzamide Formula: C23H30N4O3S MolecularWeight: 442.5743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC

InChI

InChI=1S/C23H30N4O3S/c1-4-27(5-2)15-14-24-21(28)17-10-12-19(13-11-17)25-23(31)26-22(29)18-8-7-9-20(16-18)30-6-3/h7-13,16H,4-6,14-15H2,1-3H3,(H,24,28)(H2,25,26,29,31)