2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-N-(2-prop-2-enylsulfanylphenyl)ethanamide

Systemtic Name: 2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-N-(2-prop-2-enylsulfanylphenyl)ethanamide Openeye Name: N-(2-allylsulfanylphenyl)-2-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]acetamide CAS Name: 2-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-N-[2-(prop-2-enylthio)phenyl]acetamide IUPAC Name: 2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-N-(2-prop-2-enylsulfanylphenyl)acetamide Traditional Name: N-[2-(allylthio)phenyl]-2-[4-(coumaran-5-ylmethyl)piperazino]acetamide Formula: C24H29N3O2S MolecularWeight: 423.57096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=CC=C1NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCC4

Isomeric SMILES

C=CCSC1=CC=CC=C1NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C24H29N3O2S/c1-2-15-30-23-6-4-3-5-21(23)25-24(28)18-27-12-10-26(11-13-27)17-19-7-8-22-20(16-19)9-14-29-22/h2-8,16H,1,9-15,17-18H2,(H,25,28)