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

Systemtic Name: 1-[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-yl]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(4-isopropylphenyl)-3-[(1R,2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]thiourea CAS Name: 1-[(1S,2R)-1-(4-morpholin-4-iumyl)-1-phenylpropan-2-yl]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenylpropan-2-yl]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[(1R,2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]-3-p-cumenyl-thiourea Formula: C23H32N3OS+ MolecularWeight: 398.58468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)NC(C)C(C2=CC=CC=C2)[NH+]3CCOCC3

Isomeric SMILES

C[C@H]([C@H](C1=CC=CC=C1)[NH+]2CCOCC2)NC(=S)NC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C23H31N3OS/c1-17(2)19-9-11-21(12-10-19)25-23(28)24-18(3)22(20-7-5-4-6-8-20)26-13-15-27-16-14-26/h4-12,17-18,22H,13-16H2,1-3H3,(H2,24,25,28)/p+1/t18-,22-/m1/s1