[2-azanyl-1-(9-azanyl-5-methyl-acridin-4-yl)-1-oxidanylidene-propan-2-yl]-dimethyl-[(2-morpholin-4-yl-5-nitro-1,3-thiazol-4-yl)methyl]azanium

Systemtic Name: [2-azanyl-1-(9-azanyl-5-methyl-acridin-4-yl)-1-oxidanylidene-propan-2-yl]-dimethyl-[(2-morpholin-4-yl-5-nitro-1,3-thiazol-4-yl)methyl]azanium Openeye Name: [1-amino-2-(9-amino-5-methyl-acridin-4-yl)-1-methyl-2-oxo-ethyl]-dimethyl-[(2-morpholino-5-nitro-thiazol-4-yl)methyl]ammonium CAS Name: [2-amino-1-(9-amino-5-methyl-4-acridinyl)-1-oxopropan-2-yl]-dimethyl-[[2-(4-morpholinyl)-5-nitro-4-thiazolyl]methyl]ammonium IUPAC Name: [2-amino-1-(9-amino-5-methylacridin-4-yl)-1-oxopropan-2-yl]-dimethyl-[(2-morpholin-4-yl-5-nitro-1,3-thiazol-4-yl)methyl]azanium Traditional Name: [1-amino-2-(9-amino-5-methyl-acridin-4-yl)-2-keto-1-methyl-ethyl]-dimethyl-[(2-morpholino-5-nitro-thiazol-4-yl)methyl]ammonium Formula: C27H32N7O4S+ MolecularWeight: 550.65248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C(C3=C(C(=CC=C3)C(=O)C(C)(N)[N+](C)(C)CC4=C(SC(=N4)N5CCOCC5)[N+](=O)[O-])N=C12)N

Isomeric SMILES

CC1=CC=CC2=C(C3=C(C(=CC=C3)C(=O)C(C)(N)[N+](C)(C)CC4=C(SC(=N4)N5CCOCC5)[N+](=O)[O-])N=C12)N

InChI

InChI=1S/C27H31N7O4S/c1-16-7-5-8-17-21(28)18-9-6-10-19(23(18)31-22(16)17)24(35)27(2,29)34(3,4)15-20-25(33(36)37)39-26(30-20)32-11-13-38-14-12-32/h5-10H,11-15,29H2,1-4H3,(H-,28,31,35)/p+1