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

Systemtic Name: 2-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 2-[2-(3,5-dimethylanilino)-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 2-[[2-(3,5-dimethylanilino)-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 2-[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-[[2-(3,5-dimethylanilino)-2-keto-ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CSC(C)C(=O)NC2=NOC(=C2)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CSC(C)C(=O)NC2=NOC(=C2)C)C

InChI

InChI=1S/C17H21N3O3S/c1-10-5-11(2)7-14(6-10)18-16(21)9-24-13(4)17(22)19-15-8-12(3)23-20-15/h5-8,13H,9H2,1-4H3,(H,18,21)(H,19,20,22)