1-ethyl-2-methyl-N-oxidanyl-6-oxidanylidene-4-(4,5,7,8-tetrahydrothieno[2,3-d]azepin-6-yl)pyrimidin-5-amine oxide

Systemtic Name: 1-ethyl-2-methyl-N-oxidanyl-6-oxidanylidene-4-(4,5,7,8-tetrahydrothieno[2,3-d]azepin-6-yl)pyrimidin-5-amine oxide Openeye Name: 1-ethyl-N-hydroxy-2-methyl-6-oxo-4-(4,5,7,8-tetrahydrothieno[2,3-d]azepin-6-yl)pyrimidin-5-amine oxide CAS Name: 1-ethyl-N-hydroxy-2-methyl-6-oxo-4-(4,5,7,8-tetrahydrothieno[2,3-d]azepin-6-yl)-5-pyrimidinamine oxide IUPAC Name: 1-ethyl-N-hydroxy-2-methyl-6-oxo-4-(4,5,7,8-tetrahydrothieno[2,3-d]azepin-6-yl)pyrimidin-5-amine oxide Traditional Name: 1-ethyl-N-hydroxy-6-keto-2-methyl-4-(4,5,7,8-tetrahydrothien[2,3-d]azepin-6-yl)pyrimidin-5-amine oxide Formula: C15H20N4O3S MolecularWeight: 336.4093

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC(=C(C1=O)[NH+](O)[O-])N2CCC3=C(CC2)SC=C3)C

Isomeric SMILES

CCN1C(=NC(=C(C1=O)[NH+](O)[O-])N2CCC3=C(CC2)SC=C3)C

InChI

InChI=1S/C15H20N4O3S/c1-3-18-10(2)16-14(13(15(18)20)19(21)22)17-7-4-11-6-9-23-12(11)5-8-17/h6,9,19,21H,3-5,7-8H2,1-2H3