2-[[3-methyl-2,6-bis(oxidanylidene)-7-phenacyl-purin-8-yl]methylsulfanyl]ethanehydrazide

Systemtic Name: 2-[[3-methyl-2,6-bis(oxidanylidene)-7-phenacyl-purin-8-yl]methylsulfanyl]ethanehydrazide Openeye Name: 2-[(3-methyl-2,6-dioxo-7-phenacyl-purin-8-yl)methylsulfanyl]acetohydrazide CAS Name: 2-[(3-methyl-2,6-dioxo-7-phenacyl-8-purinyl)methylthio]acetohydrazide IUPAC Name: 2-[(3-methyl-2,6-dioxo-7-phenacylpurin-8-yl)methylsulfanyl]acetohydrazide Traditional Name: 2-[(2,6-diketo-3-methyl-7-phenacyl-purin-8-yl)methylthio]acetohydrazide Formula: C17H18N6O4S MolecularWeight: 402.42762

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)CSCC(=O)NN)CC(=O)C3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)CSCC(=O)NN)CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H18N6O4S/c1-22-15-14(16(26)20-17(22)27)23(7-11(24)10-5-3-2-4-6-10)12(19-15)8-28-9-13(25)21-18/h2-6H,7-9,18H2,1H3,(H,21,25)(H,20,26,27)