N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-pyrazol-3-yl]-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-methyl-pyrazol-3-yl]-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-acetyl-N-[2-(1,1-dioxothiolan-3-yl)-5-methyl-pyrazol-3-yl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-acetyl-N-[2-(1,1-dioxo-3-thiolanyl)-5-methyl-3-pyrazolyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-acetyl-N-[2-(1,1-dioxothiolan-3-yl)-5-methylpyrazol-3-yl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-acetyl-N-[2-(1,1-diketothiolan-3-yl)-5-methyl-pyrazol-3-yl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2CN(C3=CC=CC=C3O2)C(=O)C)C4CCS(=O)(=O)C4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2CN(C3=CC=CC=C3O2)C(=O)C)C4CCS(=O)(=O)C4

InChI

InChI=1S/C19H22N4O5S/c1-12-9-18(23(21-12)14-7-8-29(26,27)11-14)20-19(25)17-10-22(13(2)24)15-5-3-4-6-16(15)28-17/h3-6,9,14,17H,7-8,10-11H2,1-2H3,(H,20,25)