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

Systemtic Name: 4-azanyl-N5-(2-ethylphenyl)-N5-[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl]-1,2-thiazole-3,5-dicarboxamide Openeye Name: 4-amino-N5-(2-ethylphenyl)-N5-[2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl]isothiazole-3,5-dicarboxamide CAS Name: 4-amino-N5-(2-ethylphenyl)-N5-[2-oxo-2-(2-oxolanylmethylamino)ethyl]isothiazole-3,5-dicarboxamide IUPAC Name: 4-amino-5-N-(2-ethylphenyl)-5-N-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]-1,2-thiazole-3,5-dicarboxamide Traditional Name: 4-amino-N'-(2-ethylphenyl)-N'-[2-keto-2-(tetrahydrofurfurylamino)ethyl]isothiazole-3,5-dicarboxamide Formula: C20H25N5O4S MolecularWeight: 431.5086

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(CC(=O)NCC2CCCO2)C(=O)C3=C(C(=NS3)C(=O)N)N

Isomeric SMILES

CCC1=CC=CC=C1N(CC(=O)NCC2CCCO2)C(=O)C3=C(C(=NS3)C(=O)N)N

InChI

InChI=1S/C20H25N5O4S/c1-2-12-6-3-4-8-14(12)25(11-15(26)23-10-13-7-5-9-29-13)20(28)18-16(21)17(19(22)27)24-30-18/h3-4,6,8,13H,2,5,7,9-11,21H2,1H3,(H2,22,27)(H,23,26)