2-methoxy-3-methyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-methoxy-3-methyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]benzamide Openeye Name: 2-methoxy-3-methyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]benzamide CAS Name: 2-methoxy-3-methyl-N-[[4-(1-pyrrolidinylmethyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-methoxy-3-methyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]benzamide Traditional Name: 2-methoxy-3-methyl-N-[[4-(pyrrolidinomethyl)phenyl]thiocarbamoyl]benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=CC=C(C=C2)CN3CCCC3

Isomeric SMILES

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=CC=C(C=C2)CN3CCCC3

InChI

InChI=1S/C21H25N3O2S/c1-15-6-5-7-18(19(15)26-2)20(25)23-21(27)22-17-10-8-16(9-11-17)14-24-12-3-4-13-24/h5-11H,3-4,12-14H2,1-2H3,(H2,22,23,25,27)