1-methyl-1-[(4-methylsulfanylphenyl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-methyl-1-[(4-methylsulfanylphenyl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-methyl-1-[(4-methylsulfanylphenyl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-methyl-1-[[4-(methylthio)phenyl]methyl]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-methyl-1-[(4-methylsulfanylphenyl)methyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-methyl-1-[4-(methylthio)benzyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C16H26N3OS2+ MolecularWeight: 340.52714

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)C(=S)NCC[NH+]2CCOCC2

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)C(=S)NCC[NH+]2CCOCC2

InChI

InChI=1S/C16H25N3OS2/c1-18(13-14-3-5-15(22-2)6-4-14)16(21)17-7-8-19-9-11-20-12-10-19/h3-6H,7-13H2,1-2H3,(H,17,21)/p+1