4-azanyl-N5-(1,3-benzodioxol-5-yl)-N5-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]-1,2-thiazole-3,5-dicarboxamide

Systemtic Name: 4-azanyl-N5-(1,3-benzodioxol-5-yl)-N5-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-(1,3-benzodioxol-5-yl)-N5-[2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-(1,3-benzodioxol-5-yl)-N5-[2-oxo-2-(2-oxolanylmethylamino)ethyl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-(1,3-benzodioxol-5-yl)-5-N-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-(1,3-benzodioxol-5-yl)-N'-[2-keto-2-(tetrahydrofurfurylamino)ethyl]isothiazole-3,5-dicarboxamide Formula: C19H21N5O6S MolecularWeight: 447.46494

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)CN(C2=CC3=C(C=C2)OCO3)C(=O)C4=C(C(=NS4)C(=O)N)N

Isomeric SMILES

C1CC(OC1)CNC(=O)CN(C2=CC3=C(C=C2)OCO3)C(=O)C4=C(C(=NS4)C(=O)N)N

InChI

InChI=1S/C19H21N5O6S/c20-15-16(18(21)26)23-31-17(15)19(27)24(8-14(25)22-7-11-2-1-5-28-11)10-3-4-12-13(6-10)30-9-29-12/h3-4,6,11H,1-2,5,7-9,20H2,(H2,21,26)(H,22,25)