3-azanyl-4-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]cyclobutane-1,2-dione

Systemtic Name: 3-azanyl-4-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]cyclobutane-1,2-dione Openeye Name: 3-amino-4-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]cyclobutane-1,2-dione CAS Name: 3-amino-4-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]cyclobutane-1,2-dione IUPAC Name: 3-amino-4-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]cyclobutane-1,2-dione Traditional Name: 3-amino-4-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]cyclobutane-1,2-quinone Formula: C11H16N4O2S MolecularWeight: 268.33534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC2C(C(=O)C2=O)N

Isomeric SMILES

CC1=C(N=CN1)CSCCNC2C(C(=O)C2=O)N

InChI

InChI=1S/C11H16N4O2S/c1-6-7(15-5-14-6)4-18-3-2-13-9-8(12)10(16)11(9)17/h5,8-9,13H,2-4,12H2,1H3,(H,14,15)