3-(5-chloranyl-2-methoxy-phenyl)-1-(3-morpholin-4-ylpropyl)-1-(phenylmethyl)thiourea

Systemtic Name: 3-(5-chloranyl-2-methoxy-phenyl)-1-(3-morpholin-4-ylpropyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(5-chloro-2-methoxy-phenyl)-1-(3-morpholinopropyl)thiourea CAS Name: 3-(5-chloro-2-methoxyphenyl)-1-[3-(4-morpholinyl)propyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(5-chloro-2-methoxyphenyl)-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 1-benzyl-3-(5-chloro-2-methoxy-phenyl)-1-(3-morpholinopropyl)thiourea Formula: C22H28ClN3O2S MolecularWeight: 433.99462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=S)N(CCCN2CCOCC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=S)N(CCCN2CCOCC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H28ClN3O2S/c1-27-21-9-8-19(23)16-20(21)24-22(29)26(17-18-6-3-2-4-7-18)11-5-10-25-12-14-28-15-13-25/h2-4,6-9,16H,5,10-15,17H2,1H3,(H,24,29)