4-butoxy-N-(3-morpholin-4-ylpropyl)benzenecarbothioamide

Systemtic Name: 4-butoxy-N-(3-morpholin-4-ylpropyl)benzenecarbothioamide Openeye Name: 4-butoxy-N-(3-morpholinopropyl)benzenecarbothioamide CAS Name: 4-butoxy-N-[3-(4-morpholinyl)propyl]benzenecarbothioamide IUPAC Name: 4-butoxy-N-(3-morpholin-4-ylpropyl)benzenecarbothioamide Traditional Name: 4-butoxy-N-(3-morpholinopropyl)thiobenzamide Formula: C18H28N2O2S MolecularWeight: 336.49212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=S)NCCCN2CCOCC2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=S)NCCCN2CCOCC2

InChI

InChI=1S/C18H28N2O2S/c1-2-3-13-22-17-7-5-16(6-8-17)18(23)19-9-4-10-20-11-14-21-15-12-20/h5-8H,2-4,9-15H2,1H3,(H,19,23)