3-(2-chloranyl-5-methoxy-phenyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 3-(2-chloranyl-5-methoxy-phenyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 3-(2-chloro-5-methoxy-phenyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(3-morpholinopropyl)thiourea CAS Name: 3-(2-chloro-5-methoxyphenyl)-1-(1-cyclohex-3-enylmethyl)-1-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 3-(2-chloro-5-methoxyphenyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 3-(2-chloro-5-methoxy-phenyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(3-morpholinopropyl)thiourea Formula: C22H32ClN3O2S MolecularWeight: 438.02638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Cl)NC(=S)N(CCCN2CCOCC2)CC3CCC=CC3

Isomeric SMILES

COC1=CC(=C(C=C1)Cl)NC(=S)N(CCCN2CCOCC2)CC3CCC=CC3

InChI

InChI=1S/C22H32ClN3O2S/c1-27-19-8-9-20(23)21(16-19)24-22(29)26(17-18-6-3-2-4-7-18)11-5-10-25-12-14-28-15-13-25/h2-3,8-9,16,18H,4-7,10-15,17H2,1H3,(H,24,29)