N'-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]carbonyl-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carbohydrazide

Systemtic Name: N'-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]carbonyl-4-ethanoyl-2,3-dihydro-1,4-benzoxazine-2-carbohydrazide Openeye Name: 4-acetyl-N'-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzoyl]-2,3-dihydro-1,4-benzoxazine-2-carbohydrazide CAS Name: 4-acetyl-N'-[[4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]phenyl]-oxomethyl]-2,3-dihydro-1,4-benzoxazine-2-carbohydrazide IUPAC Name: 4-acetyl-N'-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]benzoyl]-2,3-dihydro-1,4-benzoxazine-2-carbohydrazide Traditional Name: 4-acetyl-N'-[4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]benzoyl]-2,3-dihydro-1,4-benzoxazine-2-carbohydrazide Formula: C25H25N5O4S MolecularWeight: 491.5621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)C3CN(C4=CC=CC=C4O3)C(=O)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NNC(=O)C3CN(C4=CC=CC=C4O3)C(=O)C)C

InChI

InChI=1S/C25H25N5O4S/c1-15-12-16(2)27-25(26-15)35-14-18-8-10-19(11-9-18)23(32)28-29-24(33)22-13-30(17(3)31)20-6-4-5-7-21(20)34-22/h4-12,22H,13-14H2,1-3H3,(H,28,32)(H,29,33)