(2R)-N'-(2-oxidanylideneindol-1-ium-3-yl)-2-(phenylmethylsulfanyl)propanehydrazide

Systemtic Name: (2R)-N'-(2-oxidanylideneindol-1-ium-3-yl)-2-(phenylmethylsulfanyl)propanehydrazide Openeye Name: (2R)-2-benzylsulfanyl-N'-(2-oxoindol-1-ium-3-yl)propanehydrazide CAS Name: (2R)-N'-(2-oxo-3-indol-1-iumyl)-2-(phenylmethylthio)propanehydrazide IUPAC Name: (2R)-2-benzylsulfanyl-N'-(2-oxoindol-1-ium-3-yl)propanehydrazide Traditional Name: (2R)-2-(benzylthio)-N'-(2-ketoindol-1-ium-3-yl)propionohydrazide Formula: C18H18N3O2S+ MolecularWeight: 340.41942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC1=C2C=CC=CC2=[NH+]C1=O)SCC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NNC1=C2C=CC=CC2=[NH+]C1=O)SCC3=CC=CC=C3

InChI

InChI=1S/C18H17N3O2S/c1-12(24-11-13-7-3-2-4-8-13)17(22)21-20-16-14-9-5-6-10-15(14)19-18(16)23/h2-10,12H,11H2,1H3,(H,21,22)(H,19,20,23)/p+1/t12-/m1/s1