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

Systemtic Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[(Z)-1-(3-nitrophenyl)ethylideneamino]thiourea Openeye Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[(Z)-1-(3-nitrophenyl)ethylideneamino]thiourea CAS Name: 1-[2-(4-morpholin-4-iumyl)ethyl]-3-[(Z)-1-(3-nitrophenyl)ethylideneamino]thiourea IUPAC Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[(Z)-1-(3-nitrophenyl)ethylideneamino]thiourea Traditional Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-[(Z)-1-(3-nitrophenyl)ethylideneamino]thiourea Formula: C15H22N5O3S+ MolecularWeight: 352.43188

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCC[NH+]1CCOCC1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C15H21N5O3S/c1-12(13-3-2-4-14(11-13)20(21)22)17-18-15(24)16-5-6-19-7-9-23-10-8-19/h2-4,11H,5-10H2,1H3,(H2,16,18,24)/p+1/b17-12-