(E)-3-(4-methylphenyl)-N-[naphthalen-1-yl(4-oxidanylbutyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-methylphenyl)-N-[naphthalen-1-yl(4-oxidanylbutyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-N-[4-hydroxybutyl(1-naphthyl)carbamothioyl]-3-(p-tolyl)prop-2-enamide CAS Name: (E)-N-[[4-hydroxybutyl(1-naphthalenyl)amino]-sulfanylidenemethyl]-3-(4-methylphenyl)-2-propenamide IUPAC Name: (E)-N-[4-hydroxybutyl(naphthalen-1-yl)carbamothioyl]-3-(4-methylphenyl)prop-2-enamide Traditional Name: (E)-N-[4-hydroxybutyl(1-naphthyl)thiocarbamoyl]-3-(p-tolyl)acrylamide Formula: C25H26N2O2S MolecularWeight: 418.55114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)NC(=S)N(CCCCO)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)NC(=S)N(CCCCO)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C25H26N2O2S/c1-19-11-13-20(14-12-19)15-16-24(29)26-25(30)27(17-4-5-18-28)23-10-6-8-21-7-2-3-9-22(21)23/h2-3,6-16,28H,4-5,17-18H2,1H3,(H,26,29,30)/b16-15+