1-(3-morpholin-4-ium-4-ylpropyl)-3-[2-[(4-nitrophenyl)amino]ethyl]thiourea

Systemtic Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[2-[(4-nitrophenyl)amino]ethyl]thiourea Openeye Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[2-(4-nitroanilino)ethyl]thiourea CAS Name: 1-[3-(4-morpholin-4-iumyl)propyl]-3-[2-(4-nitroanilino)ethyl]thiourea IUPAC Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[2-(4-nitroanilino)ethyl]thiourea Traditional Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[2-(4-nitroanilino)ethyl]thiourea Formula: C16H26N5O3S+ MolecularWeight: 368.47434

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=S)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCCNC(=S)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H25N5O3S/c22-21(23)15-4-2-14(3-5-15)17-7-8-19-16(25)18-6-1-9-20-10-12-24-13-11-20/h2-5,17H,1,6-13H2,(H2,18,19,25)/p+1