2-[6-(4-methylpiperidin-1-yl)sulfonyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[2-(4-methylsulfanylphenyl)ethyl]ethanamide

Systemtic Name: 2-[6-(4-methylpiperidin-1-yl)sulfonyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-[2-(4-methylsulfanylphenyl)ethyl]ethanamide Openeye Name: 2-[6-[(4-methyl-1-piperidyl)sulfonyl]-3-oxo-1,4-benzoxazin-4-yl]-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide CAS Name: 2-[6-[(4-methyl-1-piperidinyl)sulfonyl]-3-oxo-1,4-benzoxazin-4-yl]-N-[2-[4-(methylthio)phenyl]ethyl]acetamide IUPAC Name: 2-[6-(4-methylpiperidin-1-yl)sulfonyl-3-oxo-1,4-benzoxazin-4-yl]-N-[2-(4-methylsulfanylphenyl)ethyl]acetamide Traditional Name: 2-[3-keto-6-(4-methylpiperidino)sulfonyl-1,4-benzoxazin-4-yl]-N-[2-[4-(methylthio)phenyl]ethyl]acetamide Formula: C25H31N3O5S2 MolecularWeight: 517.66074

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)NCCC4=CC=C(C=C4)SC

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)NCCC4=CC=C(C=C4)SC

InChI

InChI=1S/C25H31N3O5S2/c1-18-10-13-27(14-11-18)35(31,32)21-7-8-23-22(15-21)28(25(30)17-33-23)16-24(29)26-12-9-19-3-5-20(34-2)6-4-19/h3-8,15,18H,9-14,16-17H2,1-2H3,(H,26,29)