2-[1-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-3-oxidanylidene-piperazin-2-yl]-N-(3-methylsulfanylpropyl)ethanamide

Systemtic Name: 2-[1-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-3-oxidanylidene-piperazin-2-yl]-N-(3-methylsulfanylpropyl)ethanamide Openeye Name: 2-[1-[(E)-3-(2-methoxyphenyl)allyl]-3-oxo-piperazin-2-yl]-N-(3-methylsulfanylpropyl)acetamide CAS Name: 2-[1-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-3-oxo-2-piperazinyl]-N-[3-(methylthio)propyl]acetamide IUPAC Name: 2-[1-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-3-oxopiperazin-2-yl]-N-(3-methylsulfanylpropyl)acetamide Traditional Name: 2-[3-keto-1-[(E)-3-(2-methoxyphenyl)allyl]piperazin-2-yl]-N-[3-(methylthio)propyl]acetamide Formula: C20H29N3O3S MolecularWeight: 391.52756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CCN2CCNC(=O)C2CC(=O)NCCCSC

Isomeric SMILES

COC1=CC=CC=C1/C=C/CN2CCNC(=O)C2CC(=O)NCCCSC

InChI

InChI=1S/C20H29N3O3S/c1-26-18-9-4-3-7-16(18)8-5-12-23-13-11-22-20(25)17(23)15-19(24)21-10-6-14-27-2/h3-5,7-9,17H,6,10-15H2,1-2H3,(H,21,24)(H,22,25)/b8-5+