7-azanyl-6-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]-4H-1,4-benzoxazin-3-one

Systemtic Name: 7-azanyl-6-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]-4H-1,4-benzoxazin-3-one Openeye Name: 7-amino-6-[(1,1-dioxothiolan-3-yl)-methyl-amino]-4H-1,4-benzoxazin-3-one CAS Name: 7-amino-6-[(1,1-dioxo-3-thiolanyl)-methylamino]-4H-1,4-benzoxazin-3-one IUPAC Name: 7-amino-6-[(1,1-dioxothiolan-3-yl)-methylamino]-4H-1,4-benzoxazin-3-one Traditional Name: 7-amino-6-[(1,1-diketothiolan-3-yl)-methyl-amino]-4H-1,4-benzoxazin-3-one Formula: C13H17N3O4S MolecularWeight: 311.35678

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C2=C(C=C3C(=C2)NC(=O)CO3)N

Isomeric SMILES

CN(C1CCS(=O)(=O)C1)C2=C(C=C3C(=C2)NC(=O)CO3)N

InChI

InChI=1S/C13H17N3O4S/c1-16(8-2-3-21(18,19)7-8)11-5-10-12(4-9(11)14)20-6-13(17)15-10/h4-5,8H,2-3,6-7,14H2,1H3,(H,15,17)