1-(2-chloranyl-5-nitro-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-(2-chloranyl-5-nitro-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-(2-chloro-5-nitro-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-(2-chloro-5-nitrophenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-(2-chloro-5-nitro-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C14H20ClN4O3S+ MolecularWeight: 359.8516

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1COCC[NH+]1CCCNC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H19ClN4O3S/c15-12-3-2-11(19(20)21)10-13(12)17-14(23)16-4-1-5-18-6-8-22-9-7-18/h2-3,10H,1,4-9H2,(H2,16,17,23)/p+1