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

Systemtic Name: [(2S)-4-methylsulfanyl-1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]butan-2-yl]azanium Openeye Name: [(1S)-1-[(4-benzyloxyphenyl)carbamoyl]-3-methylsulfanyl-propyl]ammonium CAS Name: [(2S)-4-(methylthio)-1-oxo-1-(4-phenylmethoxyanilino)butan-2-yl]ammonium IUPAC Name: [(2S)-4-methylsulfanyl-1-oxo-1-(4-phenylmethoxyanilino)butan-2-yl]azanium Traditional Name: [(1S)-1-[(4-benzoxyphenyl)carbamoyl]-3-(methylthio)propyl]ammonium Formula: C18H23N2O2S+ MolecularWeight: 331.45242

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)[NH3+]

Isomeric SMILES

CSCC[C@@H](C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C18H22N2O2S/c1-23-12-11-17(19)18(21)20-15-7-9-16(10-8-15)22-13-14-5-3-2-4-6-14/h2-10,17H,11-13,19H2,1H3,(H,20,21)/p+1/t17-/m0/s1