(E)-N-(1-adamantyl)-3-(4-methylsulfanylphenyl)prop-2-enamide

Systemtic Name: (E)-N-(1-adamantyl)-3-(4-methylsulfanylphenyl)prop-2-enamide Openeye Name: (E)-N-(1-adamantyl)-3-(4-methylsulfanylphenyl)prop-2-enamide CAS Name: (E)-N-(1-adamantyl)-3-[4-(methylthio)phenyl]-2-propenamide IUPAC Name: (E)-N-(1-adamantyl)-3-(4-methylsulfanylphenyl)prop-2-enamide Traditional Name: (E)-N-(1-adamantyl)-3-[4-(methylthio)phenyl]acrylamide Formula: C20H25NOS MolecularWeight: 327.4836

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=CC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CSC1=CC=C(C=C1)/C=C/C(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H25NOS/c1-23-18-5-2-14(3-6-18)4-7-19(22)21-20-11-15-8-16(12-20)10-17(9-15)13-20/h2-7,15-17H,8-13H2,1H3,(H,21,22)/b7-4+