1-(4-butylphenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-(4-butylphenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-(4-butylphenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-(4-butylphenyl)-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-(4-butylphenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C17H28N3OS+ MolecularWeight: 322.48872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC[NH+]2CCOCC2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC[NH+]2CCOCC2

InChI

InChI=1S/C17H27N3OS/c1-2-3-4-15-5-7-16(8-6-15)19-17(22)18-9-10-20-11-13-21-14-12-20/h5-8H,2-4,9-14H2,1H3,(H2,18,19,22)/p+1