1-[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-yl]-3-phenethyl-thiourea

Systemtic Name: 1-[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-yl]-3-phenethyl-thiourea Openeye Name: 1-[(1R,2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]-3-phenethyl-thiourea CAS Name: 1-[(1S,2R)-1-(4-morpholin-4-iumyl)-1-phenylpropan-2-yl]-3-phenethylthiourea IUPAC Name: 1-[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenylpropan-2-yl]-3-phenethylthiourea Traditional Name: 1-[(1R,2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]-3-phenethyl-thiourea Formula: C22H30N3OS+ MolecularWeight: 384.5581

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)[NH+]2CCOCC2)NC(=S)NCCC3=CC=CC=C3

Isomeric SMILES

C[C@H]([C@H](C1=CC=CC=C1)[NH+]2CCOCC2)NC(=S)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H29N3OS/c1-18(24-22(27)23-13-12-19-8-4-2-5-9-19)21(20-10-6-3-7-11-20)25-14-16-26-17-15-25/h2-11,18,21H,12-17H2,1H3,(H2,23,24,27)/p+1/t18-,21-/m1/s1