1-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-phenethyl-thiourea

Systemtic Name: 1-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-phenethyl-thiourea Openeye Name: 1-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-phenethyl-thiourea CAS Name: 1-[(2S)-2-(4-fluorophenyl)-2-(4-morpholin-4-iumyl)ethyl]-3-phenethylthiourea IUPAC Name: 1-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-ylethyl]-3-phenethylthiourea Traditional Name: 1-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-phenethyl-thiourea Formula: C21H27FN3OS+ MolecularWeight: 388.521983

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=S)NCCC2=CC=CC=C2)C3=CC=C(C=C3)F

Isomeric SMILES

C1COCC[NH+]1[C@H](CNC(=S)NCCC2=CC=CC=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H26FN3OS/c22-19-8-6-18(7-9-19)20(25-12-14-26-15-13-25)16-24-21(27)23-11-10-17-4-2-1-3-5-17/h1-9,20H,10-16H2,(H2,23,24,27)/p+1/t20-/m1/s1