2-[2-(7-methyloctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 2-[2-(7-methyloctylamino)-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[2-(7-methyloctylamino)-2-oxo-ethyl]sulfanyl-propanamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[[2-(7-methyloctylamino)-2-oxoethyl]thio]propanamide IUPAC Name: 2-[2-(7-methyloctylamino)-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-[[2-keto-2-(7-methyloctylamino)ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C18H31N3O3S MolecularWeight: 369.52204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NCCCCCCC(C)C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NCCCCCCC(C)C

InChI

InChI=1S/C18H31N3O3S/c1-13(2)9-7-5-6-8-10-19-17(22)12-25-15(4)18(23)20-16-11-14(3)24-21-16/h11,13,15H,5-10,12H2,1-4H3,(H,19,22)(H,20,21,23)