4-ethyl-N-[2-[(2-methyl-3-methylsulfanyl-4-oxidanylidene-azetidin-3-yl)amino]-2-oxidanylidene-1-phenyl-ethyl]-2,3-bis(oxidanylidene)piperazine-1-carboxamide

Systemtic Name: 4-ethyl-N-[2-[(2-methyl-3-methylsulfanyl-4-oxidanylidene-azetidin-3-yl)amino]-2-oxidanylidene-1-phenyl-ethyl]-2,3-bis(oxidanylidene)piperazine-1-carboxamide Openeye Name: 4-ethyl-N-[2-[(2-methyl-3-methylsulfanyl-4-oxo-azetidin-3-yl)amino]-2-oxo-1-phenyl-ethyl]-2,3-dioxo-piperazine-1-carboxamide CAS Name: 4-ethyl-N-[2-[[2-methyl-3-(methylthio)-4-oxo-3-azetidinyl]amino]-2-oxo-1-phenylethyl]-2,3-dioxo-1-piperazinecarboxamide IUPAC Name: 4-ethyl-N-[2-[(2-methyl-3-methylsulfanyl-4-oxoazetidin-3-yl)amino]-2-oxo-1-phenylethyl]-2,3-dioxopiperazine-1-carboxamide Traditional Name: 4-ethyl-2,3-diketo-N-[2-keto-2-[[2-keto-4-methyl-3-(methylthio)azetidin-3-yl]amino]-1-phenyl-ethyl]piperazine-1-carboxamide Formula: C20H25N5O5S MolecularWeight: 447.508

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CC=C2)C(=O)NC3(C(NC3=O)C)SC

Isomeric SMILES

CCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CC=C2)C(=O)NC3(C(NC3=O)C)SC

InChI

InChI=1S/C20H25N5O5S/c1-4-24-10-11-25(17(28)16(24)27)19(30)22-14(13-8-6-5-7-9-13)15(26)23-20(31-3)12(2)21-18(20)29/h5-9,12,14H,4,10-11H2,1-3H3,(H,21,29)(H,22,30)(H,23,26)