2-[4-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-N-pyridin-2-yl-propanamide

Systemtic Name: 2-[4-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-N-pyridin-2-yl-propanamide Openeye Name: 2-[4-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-N-(2-pyridyl)propanamide CAS Name: 2-[[4-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]phenyl]thio]-N-(2-pyridinyl)propanamide IUPAC Name: 2-[4-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-N-pyridin-2-ylpropanamide Traditional Name: 2-[[4-[[(E)-3-phenylacryloyl]amino]phenyl]thio]-N-(2-pyridyl)propionamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=N1)SC2=CC=C(C=C2)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=N1)SC2=CC=C(C=C2)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C23H21N3O2S/c1-17(23(28)26-21-9-5-6-16-24-21)29-20-13-11-19(12-14-20)25-22(27)15-10-18-7-3-2-4-8-18/h2-17H,1H3,(H,25,27)(H,24,26,28)/b15-10+