2-[2-[(3,3-dimethyl-1-phenyl-butyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)ethanamide

Systemtic Name: 2-[2-[(3,3-dimethyl-1-phenyl-butyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)ethanamide Openeye Name: 2-[2-[(3,3-dimethyl-1-phenyl-butyl)amino]-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)acetamide CAS Name: 2-[[2-[(3,3-dimethyl-1-phenylbutyl)amino]-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)acetamide IUPAC Name: 2-[2-[(3,3-dimethyl-1-phenylbutyl)amino]-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide Traditional Name: 2-[[2-[(3,3-dimethyl-1-phenyl-butyl)amino]-2-keto-ethyl]thio]-N-(5-methylisoxazol-3-yl)acetamide Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CSCC(=O)NC(CC(C)(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CSCC(=O)NC(CC(C)(C)C)C2=CC=CC=C2

InChI

InChI=1S/C20H27N3O3S/c1-14-10-17(23-26-14)22-19(25)13-27-12-18(24)21-16(11-20(2,3)4)15-8-6-5-7-9-15/h5-10,16H,11-13H2,1-4H3,(H,21,24)(H,22,23,25)