N-tert-butyl-1-[7-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)carbamoyl]acridin-2-yl]methanimine oxide

Systemtic Name: N-tert-butyl-1-[7-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)carbamoyl]acridin-2-yl]methanimine oxide Openeye Name: N-tert-butyl-1-[7-[[2-hydroxy-2-oxo-1-(sulfanylmethyl)ethyl]carbamoyl]acridin-2-yl]methanimine oxide CAS Name: N-tert-butyl-1-[7-[[(1-hydroxy-3-mercapto-1-oxopropan-2-yl)amino]-oxomethyl]-2-acridinyl]methanimine oxide IUPAC Name: N-tert-butyl-1-[7-[(1-hydroxy-1-oxo-3-sulfanylpropan-2-yl)carbamoyl]acridin-2-yl]methanimine oxide Traditional Name: N-tert-butyl-1-[7-[[2-hydroxy-2-keto-1-(mercaptomethyl)ethyl]carbamoyl]acridin-2-yl]methanimine oxide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[N+](=CC1=CC2=CC3=C(C=CC(=C3)C(=O)NC(CS)C(=O)O)N=C2C=C1)[O-]

Isomeric SMILES

CC(C)(C)/[N+](=C/C1=CC2=CC3=C(C=CC(=C3)C(=O)NC(CS)C(=O)O)N=C2C=C1)/[O-]

InChI

InChI=1S/C22H23N3O4S/c1-22(2,3)25(29)11-13-4-6-17-15(8-13)10-16-9-14(5-7-18(16)23-17)20(26)24-19(12-30)21(27)28/h4-11,19,30H,12H2,1-3H3,(H,24,26)(H,27,28)/b25-11-