1-(2-morpholin-4-ium-4-ylethyl)-3-[(Z)-1-(2-phenylmethoxyphenyl)ethylideneamino]thiourea

Systemtic Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[(Z)-1-(2-phenylmethoxyphenyl)ethylideneamino]thiourea Openeye Name: 1-[(Z)-1-(2-benzyloxyphenyl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[2-(4-morpholin-4-iumyl)ethyl]-3-[(Z)-1-(2-phenylmethoxyphenyl)ethylideneamino]thiourea IUPAC Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[(Z)-1-(2-phenylmethoxyphenyl)ethylideneamino]thiourea Traditional Name: 1-[(Z)-1-(2-benzoxyphenyl)ethylideneamino]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C22H29N4O2S+ MolecularWeight: 413.55626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC[NH+]1CCOCC1)C2=CC=CC=C2OCC3=CC=CC=C3

Isomeric SMILES

C/C(=N/NC(=S)NCC[NH+]1CCOCC1)/C2=CC=CC=C2OCC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O2S/c1-18(24-25-22(29)23-11-12-26-13-15-27-16-14-26)20-9-5-6-10-21(20)28-17-19-7-3-2-4-8-19/h2-10H,11-17H2,1H3,(H2,23,25,29)/p+1/b24-18-