N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-1-ethyl-2,3-bis(oxidanylidene)-4H-quinoxaline-6-carboxamide

Systemtic Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-1-ethyl-2,3-bis(oxidanylidene)-4H-quinoxaline-6-carboxamide Openeye Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-1-ethyl-2,3-dioxo-4H-quinoxaline-6-carboxamide CAS Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-1-ethyl-2,3-dioxo-4H-quinoxaline-6-carboxamide IUPAC Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-1-ethyl-2,3-dioxo-4H-quinoxaline-6-carboxamide Traditional Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-1-ethyl-2,3-diketo-4H-quinoxaline-6-carboxamide Formula: C22H28N6O3S MolecularWeight: 456.56112

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NCCCC3=NN=C(N3C4CCCC4)SC)NC(=O)C1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NCCCC3=NN=C(N3C4CCCC4)SC)NC(=O)C1=O

InChI

InChI=1S/C22H28N6O3S/c1-3-27-17-11-10-14(13-16(17)24-20(30)21(27)31)19(29)23-12-6-9-18-25-26-22(32-2)28(18)15-7-4-5-8-15/h10-11,13,15H,3-9,12H2,1-2H3,(H,23,29)(H,24,30)