N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)-2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-propanamide

Systemtic Name: N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)-2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-propanamide Openeye Name: N-(5-methyl-4-phenyl-thiazol-2-yl)-2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanyl-propanamide CAS Name: N-(5-methyl-4-phenyl-2-thiazolyl)-2-[[3-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]phenyl]thio]propanamide IUPAC Name: N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)-2-[3-[[(E)-3-phenylprop-2-enoyl]amino]phenyl]sulfanylpropanamide Traditional Name: N-(5-methyl-4-phenyl-thiazol-2-yl)-2-[[3-[[(E)-3-phenylacryloyl]amino]phenyl]thio]propionamide Formula: C28H25N3O2S2 MolecularWeight: 499.647

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)C=CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)/C=C/C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H25N3O2S2/c1-19-26(22-12-7-4-8-13-22)30-28(35-19)31-27(33)20(2)34-24-15-9-14-23(18-24)29-25(32)17-16-21-10-5-3-6-11-21/h3-18,20H,1-2H3,(H,29,32)(H,30,31,33)/b17-16+