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

Systemtic Name: N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[[4-(morpholinomethyl)phenyl]carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[4-(4-morpholinylmethyl)anilino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]-3-propoxybenzamide Traditional Name: N-[[4-(morpholinomethyl)phenyl]thiocarbamoyl]-3-propoxy-benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CN3CCOCC3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CN3CCOCC3

InChI

InChI=1S/C22H27N3O3S/c1-2-12-28-20-5-3-4-18(15-20)21(26)24-22(29)23-19-8-6-17(7-9-19)16-25-10-13-27-14-11-25/h3-9,15H,2,10-14,16H2,1H3,(H2,23,24,26,29)