furan-2-ylmethyl-methyl-[(2S)-1-oxidanylidene-1-[(2-phenylsulfanylphenyl)amino]propan-2-yl]azanium

Systemtic Name: furan-2-ylmethyl-methyl-[(2S)-1-oxidanylidene-1-[(2-phenylsulfanylphenyl)amino]propan-2-yl]azanium Openeye Name: 2-furylmethyl-methyl-[(1S)-1-methyl-2-oxo-2-(2-phenylsulfanylanilino)ethyl]ammonium CAS Name: 2-furanylmethyl-methyl-[(2S)-1-oxo-1-[2-(phenylthio)anilino]propan-2-yl]ammonium IUPAC Name: furan-2-ylmethyl-methyl-[(2S)-1-oxo-1-(2-phenylsulfanylanilino)propan-2-yl]azanium Traditional Name: 2-furfuryl-[(1S)-2-keto-1-methyl-2-[2-(phenylthio)anilino]ethyl]-methyl-ammonium Formula: C21H23N2O2S+ MolecularWeight: 367.48452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)[NH+](C)CC3=CC=CO3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)[NH+](C)CC3=CC=CO3

InChI

InChI=1S/C21H22N2O2S/c1-16(23(2)15-17-9-8-14-25-17)21(24)22-19-12-6-7-13-20(19)26-18-10-4-3-5-11-18/h3-14,16H,15H2,1-2H3,(H,22,24)/p+1/t16-/m0/s1