ethyl 6-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-5-oxidanylidene-thiomorpholine-3-carboxylate

Systemtic Name: ethyl 6-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-5-oxidanylidene-thiomorpholine-3-carboxylate Openeye Name: ethyl 6-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]-5-oxo-thiomorpholine-3-carboxylate CAS Name: 6-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-5-oxo-3-thiomorpholinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-5-oxothiomorpholine-3-carboxylate Traditional Name: 6-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]-5-keto-thiomorpholine-3-carboxylic acid ethyl ester Formula: C16H18N2O6S MolecularWeight: 366.38892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSC(C(=O)N1)CC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC(=O)C1CSC(C(=O)N1)CC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H18N2O6S/c1-2-22-16(21)10-7-25-13(15(20)18-10)6-14(19)17-9-3-4-11-12(5-9)24-8-23-11/h3-5,10,13H,2,6-8H2,1H3,(H,17,19)(H,18,20)