1-[(1R)-1-(4-methylsulfonylphenyl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[(1R)-1-(4-methylsulfonylphenyl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[(1R)-1-(4-methylsulfonylphenyl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[(1R)-1-(4-methylsulfonylphenyl)ethyl]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[(1R)-1-(4-methylsulfonylphenyl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[(1R)-1-(4-mesylphenyl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C16H26N3O3S2+ MolecularWeight: 372.52594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O3S2/c1-13(14-3-5-15(6-4-14)24(2,20)21)18-16(23)17-7-8-19-9-11-22-12-10-19/h3-6,13H,7-12H2,1-2H3,(H2,17,18,23)/p+1/t13-/m1/s1