1-cyclopropyl-3-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]thiourea

Systemtic Name: 1-cyclopropyl-3-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]thiourea Openeye Name: 1-cyclopropyl-3-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]thiourea CAS Name: 1-cyclopropyl-3-[(2R)-2-(4-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-cyclopropyl-3-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]thiourea Traditional Name: 1-cyclopropyl-3-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]thiourea Formula: C17H26N3O2S+ MolecularWeight: 336.47224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=S)NC2CC2)[NH+]3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=S)NC2CC2)[NH+]3CCOCC3

InChI

InChI=1S/C17H25N3O2S/c1-21-15-6-2-13(3-7-15)16(20-8-10-22-11-9-20)12-18-17(23)19-14-4-5-14/h2-3,6-7,14,16H,4-5,8-12H2,1H3,(H2,18,19,23)/p+1/t16-/m0/s1