3-tert-butylsulfanyl-N-(3-cyano-1,5-dimethoxy-pentan-3-yl)-2-[[6-(2-methoxyethoxy)-2-oxidanylidene-1,3-benzoxazin-4-yl]amino]propanamide

Systemtic Name: 3-tert-butylsulfanyl-N-(3-cyano-1,5-dimethoxy-pentan-3-yl)-2-[[6-(2-methoxyethoxy)-2-oxidanylidene-1,3-benzoxazin-4-yl]amino]propanamide Openeye Name: 3-tert-butylsulfanyl-N-[1-cyano-3-methoxy-1-(2-methoxyethyl)propyl]-2-[[6-(2-methoxyethoxy)-2-oxo-1,3-benzoxazin-4-yl]amino]propanamide CAS Name: 3-(tert-butylthio)-N-(3-cyano-1,5-dimethoxypentan-3-yl)-2-[[6-(2-methoxyethoxy)-2-oxo-1,3-benzoxazin-4-yl]amino]propanamide IUPAC Name: 3-tert-butylsulfanyl-N-(3-cyano-1,5-dimethoxypentan-3-yl)-2-[[6-(2-methoxyethoxy)-2-oxo-1,3-benzoxazin-4-yl]amino]propanamide Traditional Name: 3-(tert-butylthio)-N-[1-cyano-3-methoxy-1-(2-methoxyethyl)propyl]-2-[[2-keto-6-(2-methoxyethoxy)-1,3-benzoxazin-4-yl]amino]propionamide Formula: C26H38N4O7S MolecularWeight: 550.66752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(C(=O)NC(CCOC)(CCOC)C#N)NC1=NC(=O)OC2=C1C=C(C=C2)OCCOC

Isomeric SMILES

CC(C)(C)SCC(C(=O)NC(CCOC)(CCOC)C#N)NC1=NC(=O)OC2=C1C=C(C=C2)OCCOC

InChI

InChI=1S/C26H38N4O7S/c1-25(2,3)38-16-20(23(31)30-26(17-27,9-11-33-4)10-12-34-5)28-22-19-15-18(36-14-13-35-6)7-8-21(19)37-24(32)29-22/h7-8,15,20H,9-14,16H2,1-6H3,(H,30,31)(H,28,29,32)