[(2S)-1-[(4-tert-butylphenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-[(4-tert-butylphenyl)amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-[(4-tert-butylphenyl)carbamoyl]-3-methylsulfanyl-propyl]ammonium CAS Name: [(2S)-1-(4-tert-butylanilino)-4-(methylthio)-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(4-tert-butylanilino)-4-methylsulfanyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[(4-tert-butylphenyl)carbamoyl]-3-(methylthio)propyl]ammonium Formula: C15H25N2OS+ MolecularWeight: 281.4368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C(CCSC)[NH3+]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)[C@H](CCSC)[NH3+]

InChI

InChI=1S/C15H24N2OS/c1-15(2,3)11-5-7-12(8-6-11)17-14(18)13(16)9-10-19-4/h5-8,13H,9-10,16H2,1-4H3,(H,17,18)/p+1/t13-/m0/s1