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

Systemtic Name: N-(3-cyclohexylsulfanylpropyl)-2-[6-(4-methylpiperidin-1-yl)sulfonyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanamide Openeye Name: N-(3-cyclohexylsulfanylpropyl)-2-[6-[(4-methyl-1-piperidyl)sulfonyl]-3-oxo-1,4-benzoxazin-4-yl]acetamide CAS Name: N-[3-(cyclohexylthio)propyl]-2-[6-[(4-methyl-1-piperidinyl)sulfonyl]-3-oxo-1,4-benzoxazin-4-yl]acetamide IUPAC Name: N-(3-cyclohexylsulfanylpropyl)-2-[6-(4-methylpiperidin-1-yl)sulfonyl-3-oxo-1,4-benzoxazin-4-yl]acetamide Traditional Name: N-[3-(cyclohexylthio)propyl]-2-[3-keto-6-(4-methylpiperidino)sulfonyl-1,4-benzoxazin-4-yl]acetamide Formula: C25H37N3O5S2 MolecularWeight: 523.70838

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)NCCCSC4CCCCC4

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3CC(=O)NCCCSC4CCCCC4

InChI

InChI=1S/C25H37N3O5S2/c1-19-10-13-27(14-11-19)35(31,32)21-8-9-23-22(16-21)28(25(30)18-33-23)17-24(29)26-12-5-15-34-20-6-3-2-4-7-20/h8-9,16,19-20H,2-7,10-15,17-18H2,1H3,(H,26,29)