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

Systemtic Name: 3,4-dimethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]benzamide Openeye Name: 3,4-dimethoxy-N-[[4-(morpholinomethyl)phenyl]carbamothioyl]benzamide CAS Name: 3,4-dimethoxy-N-[[4-(4-morpholinylmethyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]benzamide Traditional Name: 3,4-dimethoxy-N-[[4-(morpholinomethyl)phenyl]thiocarbamoyl]benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CN3CCOCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CN3CCOCC3)OC

InChI

InChI=1S/C21H25N3O4S/c1-26-18-8-5-16(13-19(18)27-2)20(25)23-21(29)22-17-6-3-15(4-7-17)14-24-9-11-28-12-10-24/h3-8,13H,9-12,14H2,1-2H3,(H2,22,23,25,29)