2-[2-[2-(4-bromophenyl)propan-2-ylamino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: 2-[2-[2-(4-bromophenyl)propan-2-ylamino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: 2-[2-[[1-(4-bromophenyl)-1-methyl-ethyl]amino]-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)propanamide CAS Name: 2-[[2-[2-(4-bromophenyl)propan-2-ylamino]-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: 2-[2-[2-(4-bromophenyl)propan-2-ylamino]-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: 2-[[2-[[1-(4-bromophenyl)-1-methyl-ethyl]amino]-2-keto-ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C18H22BrN3O3S MolecularWeight: 440.35458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC(C)(C)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC(C)(C)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H22BrN3O3S/c1-11-9-15(22-25-11)20-17(24)12(2)26-10-16(23)21-18(3,4)13-5-7-14(19)8-6-13/h5-9,12H,10H2,1-4H3,(H,21,23)(H,20,22,24)