(E)-N-[(3-heptoxyphenyl)carbamothioyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[(3-heptoxyphenyl)carbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[(3-heptoxyphenyl)carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[(3-heptoxyanilino)-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[(3-heptoxyphenyl)carbamothioyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[(3-heptoxyphenyl)thiocarbamoyl]-3-phenyl-acrylamide Formula: C23H28N2O2S MolecularWeight: 396.54562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C23H28N2O2S/c1-2-3-4-5-9-17-27-21-14-10-13-20(18-21)24-23(28)25-22(26)16-15-19-11-7-6-8-12-19/h6-8,10-16,18H,2-5,9,17H2,1H3,(H2,24,25,26,28)/b16-15+