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

Systemtic Name: 2-[4-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-N-(4-propan-2-ylphenyl)propanamide Openeye Name: N-(4-isopropylphenyl)-2-[4-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-propanamide CAS Name: 2-[[4-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]phenyl]thio]-N-(4-propan-2-ylphenyl)propanamide IUPAC Name: 2-[4-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-N-(4-propan-2-ylphenyl)propanamide Traditional Name: N-p-cumenyl-2-[[4-[[(E)-3-phenylacryloyl]amino]phenyl]thio]propionamide Formula: C27H28N2O2S MolecularWeight: 444.58842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C27H28N2O2S/c1-19(2)22-10-12-24(13-11-22)29-27(31)20(3)32-25-16-14-23(15-17-25)28-26(30)18-9-21-7-5-4-6-8-21/h4-20H,1-3H3,(H,28,30)(H,29,31)/b18-9+