2-methoxy-N-[(2R)-4-methylsulfanyl-1-oxidanylidene-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]butan-2-yl]benzamide

Systemtic Name: 2-methoxy-N-[(2R)-4-methylsulfanyl-1-oxidanylidene-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]butan-2-yl]benzamide Openeye Name: N-[(1R)-1-[4-[(E)-cinnamyl]piperazine-1-carbonyl]-3-methylsulfanyl-propyl]-2-methoxy-benzamide CAS Name: 2-methoxy-N-[(2R)-4-(methylthio)-1-oxo-1-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]butan-2-yl]benzamide IUPAC Name: 2-methoxy-N-[(2R)-4-methylsulfanyl-1-oxo-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]butan-2-yl]benzamide Traditional Name: N-[(1R)-1-[4-[(E)-cinnamyl]piperazine-1-carbonyl]-3-(methylthio)propyl]-2-methoxy-benzamide Formula: C26H33N3O3S MolecularWeight: 467.62352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)N2CCN(CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1C(=O)N[C@H](CCSC)C(=O)N2CCN(CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C26H33N3O3S/c1-32-24-13-7-6-12-22(24)25(30)27-23(14-20-33-2)26(31)29-18-16-28(17-19-29)15-8-11-21-9-4-3-5-10-21/h3-13,23H,14-20H2,1-2H3,(H,27,30)/b11-8+/t23-/m1/s1