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

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxidanylidene-2-[(1-phenylcyclohexyl)methylamino]ethyl]sulfanyl-propanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[2-oxo-2-[(1-phenylcyclohexyl)methylamino]ethyl]sulfanyl-propanamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[[2-oxo-2-[(1-phenylcyclohexyl)methylamino]ethyl]thio]propanamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[(1-phenylcyclohexyl)methylamino]ethyl]sulfanylpropanamide Traditional Name: 2-[[2-keto-2-[(1-phenylcyclohexyl)methylamino]ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NCC2(CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NCC2(CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O3S/c1-16-13-19(25-28-16)24-21(27)17(2)29-14-20(26)23-15-22(11-7-4-8-12-22)18-9-5-3-6-10-18/h3,5-6,9-10,13,17H,4,7-8,11-12,14-15H2,1-2H3,(H,23,26)(H,24,25,27)