3-phenyl-1-[[4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]methyl]-1-propan-2-yl-urea

Systemtic Name: 3-phenyl-1-[[4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]methyl]-1-propan-2-yl-urea Openeye Name: 1-[[4-[4-[(E)-cinnamyl]piperazine-1-carbonyl]thiazol-2-yl]methyl]-1-isopropyl-3-phenyl-urea CAS Name: 1-[[4-[oxo-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methyl]-2-thiazolyl]methyl]-3-phenyl-1-propan-2-ylurea IUPAC Name: 3-phenyl-1-[[4-[4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbonyl]-1,3-thiazol-2-yl]methyl]-1-propan-2-ylurea Traditional Name: 1-[[4-[4-[(E)-cinnamyl]piperazine-1-carbonyl]thiazol-2-yl]methyl]-1-isopropyl-3-phenyl-urea Formula: C28H33N5O2S MolecularWeight: 503.65892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=NC(=CS1)C(=O)N2CCN(CC2)CC=CC3=CC=CC=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC(C)N(CC1=NC(=CS1)C(=O)N2CCN(CC2)C/C=C/C3=CC=CC=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C28H33N5O2S/c1-22(2)33(28(35)29-24-13-7-4-8-14-24)20-26-30-25(21-36-26)27(34)32-18-16-31(17-19-32)15-9-12-23-10-5-3-6-11-23/h3-14,21-22H,15-20H2,1-2H3,(H,29,35)/b12-9+