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

Systemtic Name: 2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-N-(4-propan-2-ylphenyl)butanamide Openeye Name: N-(4-isopropylphenyl)-2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-butanamide CAS Name: 2-[[3-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]phenyl]thio]-N-(4-propan-2-ylphenyl)butanamide IUPAC Name: 2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-N-(4-propan-2-ylphenyl)butanamide Traditional Name: N-p-cumenyl-2-[[3-[[(E)-3-phenylacryloyl]amino]phenyl]thio]butyramide Formula: C28H30N2O2S MolecularWeight: 458.615

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(C)C)SC2=CC=CC(=C2)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C(C)C)SC2=CC=CC(=C2)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C28H30N2O2S/c1-4-26(28(32)30-23-16-14-22(15-17-23)20(2)3)33-25-12-8-11-24(19-25)29-27(31)18-13-21-9-6-5-7-10-21/h5-20,26H,4H2,1-3H3,(H,29,31)(H,30,32)/b18-13+