N-[2-(furan-2-ylmethylsulfanyl)ethyl]-1-[(2,4,6-trimethoxyphenyl)methyl]aziridine-2-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-1-[(2,4,6-trimethoxyphenyl)methyl]aziridine-2-carboxamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-1-[(2,4,6-trimethoxyphenyl)methyl]aziridine-2-carboxamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-1-[(2,4,6-trimethoxyphenyl)methyl]-2-aziridinecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-1-[(2,4,6-trimethoxyphenyl)methyl]aziridine-2-carboxamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-1-(2,4,6-trimethoxybenzyl)ethylenimine-2-carboxamide Formula: C20H26N2O5S MolecularWeight: 406.49584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)CN2CC2C(=O)NCCSCC3=CC=CO3)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)CN2CC2C(=O)NCCSCC3=CC=CO3)OC

InChI

InChI=1S/C20H26N2O5S/c1-24-15-9-18(25-2)16(19(10-15)26-3)11-22-12-17(22)20(23)21-6-8-28-13-14-5-4-7-27-14/h4-5,7,9-10,17H,6,8,11-13H2,1-3H3,(H,21,23)