3-[7-(2,2-dimethylpropylsulfanyl)naphthalen-1-yl]-N-prop-2-enyl-propanamide

Systemtic Name: 3-[7-(2,2-dimethylpropylsulfanyl)naphthalen-1-yl]-N-prop-2-enyl-propanamide Openeye Name: N-allyl-3-[7-(2,2-dimethylpropylsulfanyl)-1-naphthyl]propanamide CAS Name: 3-[7-(2,2-dimethylpropylthio)-1-naphthalenyl]-N-prop-2-enylpropanamide IUPAC Name: 3-[7-(2,2-dimethylpropylsulfanyl)naphthalen-1-yl]-N-prop-2-enylpropanamide Traditional Name: N-allyl-3-[7-(neopentylthio)-1-naphthyl]propionamide Formula: C21H27NOS MolecularWeight: 341.51018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CSC1=CC2=C(C=CC=C2CCC(=O)NCC=C)C=C1

Isomeric SMILES

CC(C)(C)CSC1=CC2=C(C=CC=C2CCC(=O)NCC=C)C=C1

InChI

InChI=1S/C21H27NOS/c1-5-13-22-20(23)12-10-17-8-6-7-16-9-11-18(14-19(16)17)24-15-21(2,3)4/h5-9,11,14H,1,10,12-13,15H2,2-4H3,(H,22,23)