(E)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-3-phenylsulfanyl-prop-2-enamide

Systemtic Name: (E)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-3-phenylsulfanyl-prop-2-enamide Openeye Name: (E)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-3-phenylsulfanyl-prop-2-enamide CAS Name: (E)-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-3-(phenylthio)-2-propenamide IUPAC Name: (E)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-3-phenylsulfanylprop-2-enamide Traditional Name: (E)-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]-3-(phenylthio)acrylamide Formula: C21H25N2O2S+ MolecularWeight: 369.5004

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)C=CSC3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)/C=C/SC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2S/c24-21(10-15-26-20-8-2-1-3-9-20)22-16-18-6-4-5-7-19(18)17-23-11-13-25-14-12-23/h1-10,15H,11-14,16-17H2,(H,22,24)/p+1/b15-10+