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

Systemtic Name: 1-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-(2-methylprop-2-enyl)thiourea Openeye Name: 1-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-(2-methylallyl)thiourea CAS Name: 1-[(2R)-2-(4-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]-3-(2-methylprop-2-enyl)thiourea IUPAC Name: 1-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]-3-(2-methylprop-2-enyl)thiourea Traditional Name: 1-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-(2-methylallyl)thiourea Formula: C18H28N3O2S+ MolecularWeight: 350.49882

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CNC(=S)NCC(C1=CC=C(C=C1)OC)[NH+]2CCOCC2

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O2S/c1-14(2)12-19-18(24)20-13-17(21-8-10-23-11-9-21)15-4-6-16(22-3)7-5-15/h4-7,17H,1,8-13H2,2-3H3,(H2,19,20,24)/p+1/t17-/m0/s1