methyl 4-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbothioylamino]butanoate

Systemtic Name: methyl 4-[[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbothioylamino]butanoate Openeye Name: methyl 4-[[4-[(E)-cinnamyl]piperazine-1-carbothioyl]amino]butanoate CAS Name: 4-[[[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbothioyl]amino]butanoate Traditional Name: 4-[[4-[(E)-cinnamyl]piperazine-1-carbothioyl]amino]butyric acid methyl ester Formula: C19H27N3O2S MolecularWeight: 361.50158

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=S)N1CCN(CC1)CC=CC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCCNC(=S)N1CCN(CC1)C/C=C/C2=CC=CC=C2

InChI

InChI=1S/C19H27N3O2S/c1-24-18(23)10-5-11-20-19(25)22-15-13-21(14-16-22)12-6-9-17-7-3-2-4-8-17/h2-4,6-9H,5,10-16H2,1H3,(H,20,25)/b9-6+