1-(3-chloranyl-4-methoxy-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-(3-chloranyl-4-methoxy-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-(3-chloro-4-methoxy-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-(3-chloro-4-methoxyphenyl)-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-(3-chloro-4-methoxyphenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-(3-chloro-4-methoxy-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C15H23ClN3O2S+ MolecularWeight: 344.88002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NCCC[NH+]2CCOCC2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NCCC[NH+]2CCOCC2)Cl

InChI

InChI=1S/C15H22ClN3O2S/c1-20-14-4-3-12(11-13(14)16)18-15(22)17-5-2-6-19-7-9-21-10-8-19/h3-4,11H,2,5-10H2,1H3,(H2,17,18,22)/p+1