[2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: [2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: [2-(cyclopropylcarbamoylamino)-2-oxo-ethyl]-methyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: [2-[[(cyclopropylamino)-oxomethyl]amino]-2-oxoethyl]-methyl-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: [2-(cyclopropylcarbamoylamino)-2-oxoethyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [2-(cyclopropylcarbamoylamino)-2-keto-ethyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C15H22N3O2S+ MolecularWeight: 308.41908

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC(=O)NC2CC2

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)SC)CC(=O)NC(=O)NC2CC2

InChI

InChI=1S/C15H21N3O2S/c1-18(9-11-3-7-13(21-2)8-4-11)10-14(19)17-15(20)16-12-5-6-12/h3-4,7-8,12H,5-6,9-10H2,1-2H3,(H2,16,17,19,20)/p+1