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

Systemtic Name: 2-[2-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)ethanamide Openeye Name: 2-[2-[(5-bromo-2-methoxy-phenyl)methyl-methyl-amino]-2-oxo-ethyl]sulfanyl-N-(5-methylisoxazol-3-yl)acetamide CAS Name: 2-[[2-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-2-oxoethyl]thio]-N-(5-methyl-3-isoxazolyl)acetamide IUPAC Name: 2-[2-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)acetamide Traditional Name: 2-[[2-[(5-bromo-2-methoxy-benzyl)-methyl-amino]-2-keto-ethyl]thio]-N-(5-methylisoxazol-3-yl)acetamide Formula: C17H20BrN3O4S MolecularWeight: 442.3274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CSCC(=O)N(C)CC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CSCC(=O)N(C)CC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C17H20BrN3O4S/c1-11-6-15(20-25-11)19-16(22)9-26-10-17(23)21(2)8-12-7-13(18)4-5-14(12)24-3/h4-7H,8-10H2,1-3H3,(H,19,20,22)