N-(aziridin-1-ylcarbothioyl)-3,4,5-trimethoxy-benzamide

Systemtic Name: N-(aziridin-1-ylcarbothioyl)-3,4,5-trimethoxy-benzamide Openeye Name: N-(aziridine-1-carbothioyl)-3,4,5-trimethoxy-benzamide CAS Name: N-[1-aziridinyl(sulfanylidene)methyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-(aziridine-1-carbothioyl)-3,4,5-trimethoxybenzamide Traditional Name: N-(ethylenimine-1-carbothioyl)-3,4,5-trimethoxy-benzamide Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)N2CC2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)N2CC2

InChI

InChI=1S/C13H16N2O4S/c1-17-9-6-8(7-10(18-2)11(9)19-3)12(16)14-13(20)15-4-5-15/h6-7H,4-5H2,1-3H3,(H,14,16,20)