2-[2-(2-ethylhexylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 2-[2-(2-ethylhexylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 2-[2-(2-ethylhexylamino)-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 2-[[2-(2-ethylhexylamino)-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 2-[2-(2-ethylhexylamino)-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-[[2-(2-ethylhexylamino)-2-keto-ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C17H29N3O3S MolecularWeight: 355.49546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)CSC(C)C(=O)NC1=NOC(=C1)C

Isomeric SMILES

CCCCC(CC)CNC(=O)CSC(C)C(=O)NC1=NOC(=C1)C

InChI

InChI=1S/C17H29N3O3S/c1-5-7-8-14(6-2)10-18-16(21)11-24-13(4)17(22)19-15-9-12(3)23-20-15/h9,13-14H,5-8,10-11H2,1-4H3,(H,18,21)(H,19,20,22)