3,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]benzamide Openeye Name: 3,5-dimethyl-N-[[4-(morpholinomethyl)phenyl]carbamothioyl]benzamide CAS Name: 3,5-dimethyl-N-[[4-(4-morpholinylmethyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dimethyl-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]benzamide Traditional Name: 3,5-dimethyl-N-[[4-(morpholinomethyl)phenyl]thiocarbamoyl]benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CN3CCOCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CN3CCOCC3)C

InChI

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