1-methyl-3-(2-morpholin-4-ium-4-ylethyl)-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea

Systemtic Name: 1-methyl-3-(2-morpholin-4-ium-4-ylethyl)-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea Openeye Name: 1-methyl-3-(2-morpholin-4-ium-4-ylethyl)-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea CAS Name: 1-methyl-3-[2-(4-morpholin-4-iumyl)ethyl]-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea IUPAC Name: 1-methyl-3-(2-morpholin-4-ium-4-ylethyl)-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea Traditional Name: 1-methyl-3-(2-morpholin-4-ium-4-ylethyl)-1-[(1R)-1-(3-nitrophenyl)ethyl]thiourea Formula: C16H25N4O3S+ MolecularWeight: 353.4597

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=S)NCC[NH+]2CCOCC2

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=S)NCC[NH+]2CCOCC2

InChI

InChI=1S/C16H24N4O3S/c1-13(14-4-3-5-15(12-14)20(21)22)18(2)16(24)17-6-7-19-8-10-23-11-9-19/h3-5,12-13H,6-11H2,1-2H3,(H,17,24)/p+1/t13-/m1/s1