(E)-N-[3-(dimethylamino)-2,2-dimethyl-propyl]-3-(4-methylsulfanylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[3-(dimethylamino)-2,2-dimethyl-propyl]-3-(4-methylsulfanylphenyl)prop-2-enamide Openeye Name: (E)-N-[3-(dimethylamino)-2,2-dimethyl-propyl]-3-(4-methylsulfanylphenyl)prop-2-enamide CAS Name: (E)-N-[3-(dimethylamino)-2,2-dimethylpropyl]-3-[4-(methylthio)phenyl]-2-propenamide IUPAC Name: (E)-N-[3-(dimethylamino)-2,2-dimethylpropyl]-3-(4-methylsulfanylphenyl)prop-2-enamide Traditional Name: (E)-N-[3-(dimethylamino)-2,2-dimethyl-propyl]-3-[4-(methylthio)phenyl]acrylamide Formula: C17H26N2OS MolecularWeight: 306.46614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C=CC1=CC=C(C=C1)SC)CN(C)C

Isomeric SMILES

CC(C)(CNC(=O)/C=C/C1=CC=C(C=C1)SC)CN(C)C

InChI

InChI=1S/C17H26N2OS/c1-17(2,13-19(3)4)12-18-16(20)11-8-14-6-9-15(21-5)10-7-14/h6-11H,12-13H2,1-5H3,(H,18,20)/b11-8+