1-[(3,5-dimethoxyphenyl)methyl]-N-(2-oxidanylidenethiolan-3-yl)aziridine-2-carboxamide

Systemtic Name: 1-[(3,5-dimethoxyphenyl)methyl]-N-(2-oxidanylidenethiolan-3-yl)aziridine-2-carboxamide Openeye Name: 1-[(3,5-dimethoxyphenyl)methyl]-N-(2-oxotetrahydrothiophen-3-yl)aziridine-2-carboxamide CAS Name: 1-[(3,5-dimethoxyphenyl)methyl]-N-(2-oxo-3-thiolanyl)-2-aziridinecarboxamide IUPAC Name: 1-[(3,5-dimethoxyphenyl)methyl]-N-(2-oxothiolan-3-yl)aziridine-2-carboxamide Traditional Name: 1-(3,5-dimethoxybenzyl)-N-(2-ketotetrahydrothiophen-3-yl)ethylenimine-2-carboxamide Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CN2CC2C(=O)NC3CCSC3=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CN2CC2C(=O)NC3CCSC3=O)OC

InChI

InChI=1S/C16H20N2O4S/c1-21-11-5-10(6-12(7-11)22-2)8-18-9-14(18)15(19)17-13-3-4-23-16(13)20/h5-7,13-14H,3-4,8-9H2,1-2H3,(H,17,19)