methyl-[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-2-oxidanylidene-ethyl]-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium

Systemtic Name: methyl-[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-2-oxidanylidene-ethyl]-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium Openeye Name: methyl-[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-2-oxo-ethyl]-[(1S)-tetralin-1-yl]ammonium CAS Name: methyl-[2-[methyl-[[4-(methylthio)phenyl]methyl]amino]-2-oxoethyl]-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]ammonium IUPAC Name: methyl-[2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-2-oxoethyl]-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]azanium Traditional Name: [2-keto-2-[methyl-[4-(methylthio)benzyl]amino]ethyl]-methyl-[(1S)-tetralin-1-yl]ammonium Formula: C22H29N2OS+ MolecularWeight: 369.54346

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(=O)N(C)CC1=CC=C(C=C1)SC)C2CCCC3=CC=CC=C23

Isomeric SMILES

C[NH+](CC(=O)N(C)CC1=CC=C(C=C1)SC)[C@H]2CCCC3=CC=CC=C23

InChI

InChI=1S/C22H28N2OS/c1-23(21-10-6-8-18-7-4-5-9-20(18)21)16-22(25)24(2)15-17-11-13-19(26-3)14-12-17/h4-5,7,9,11-14,21H,6,8,10,15-16H2,1-3H3/p+1/t21-/m0/s1