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

Systemtic Name: 1-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(4-isopropylphenyl)-3-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]thiourea CAS Name: 1-[(1S)-2-(4-morpholin-4-iumyl)-1-phenylethyl]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-3-p-cumenyl-thiourea Formula: C22H30N3OS+ MolecularWeight: 384.5581

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3OS/c1-17(2)18-8-10-20(11-9-18)23-22(27)24-21(19-6-4-3-5-7-19)16-25-12-14-26-15-13-25/h3-11,17,21H,12-16H2,1-2H3,(H2,23,24,27)/p+1/t21-/m1/s1