N-(3-cyclohexylsulfanylpropyl)-2-(3-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-(3-cyclohexylsulfanylpropyl)-2-(3-oxidanylidene-6-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-(3-cyclohexylsulfanylpropyl)-2-(3-oxo-6-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-4-yl)acetamide CAS Name: N-[3-(cyclohexylthio)propyl]-2-[3-oxo-6-(1-pyrrolidinylsulfonyl)-1,4-benzoxazin-4-yl]acetamide IUPAC Name: N-(3-cyclohexylsulfanylpropyl)-2-(3-oxo-6-pyrrolidin-1-ylsulfonyl-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-[3-(cyclohexylthio)propyl]-2-(3-keto-6-pyrrolidinosulfonyl-1,4-benzoxazin-4-yl)acetamide Formula: C23H33N3O5S2 MolecularWeight: 495.65522

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCCCNC(=O)CN2C(=O)COC3=C2C=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

C1CCC(CC1)SCCCNC(=O)CN2C(=O)COC3=C2C=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C23H33N3O5S2/c27-22(24-11-6-14-32-18-7-2-1-3-8-18)16-26-20-15-19(9-10-21(20)31-17-23(26)28)33(29,30)25-12-4-5-13-25/h9-10,15,18H,1-8,11-14,16-17H2,(H,24,27)