1-(4-iodanyl-3-methyl-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-(4-iodanyl-3-methyl-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-(4-iodo-3-methyl-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-(4-iodo-3-methylphenyl)-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-(4-iodo-3-methylphenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-(4-iodo-3-methyl-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C14H21IN3OS+ MolecularWeight: 406.30551

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)NCC[NH+]2CCOCC2)I

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)NCC[NH+]2CCOCC2)I

InChI

InChI=1S/C14H20IN3OS/c1-11-10-12(2-3-13(11)15)17-14(20)16-4-5-18-6-8-19-9-7-18/h2-3,10H,4-9H2,1H3,(H2,16,17,20)/p+1