1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]thiourea

Systemtic Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]thiourea Openeye Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-1-(4-morpholinophenyl)ethylideneamino]thiourea CAS Name: 1-[3-(4-morpholin-4-iumyl)propyl]-3-[(Z)-1-[4-(4-morpholinyl)phenyl]ethylideneamino]thiourea IUPAC Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-1-(4-morpholin-4-ylphenyl)ethylideneamino]thiourea Traditional Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(Z)-1-(4-morpholinophenyl)ethylideneamino]thiourea Formula: C20H32N5O2S+ MolecularWeight: 406.56538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCCC[NH+]1CCOCC1)C2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

C/C(=N/NC(=S)NCCC[NH+]1CCOCC1)/C2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C20H31N5O2S/c1-17(18-3-5-19(6-4-18)25-11-15-27-16-12-25)22-23-20(28)21-7-2-8-24-9-13-26-14-10-24/h3-6H,2,7-16H2,1H3,(H2,21,23,28)/p+1/b22-17-