9-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]amino]-7-methoxy-N-oxidanyl-acridin-3-amine oxide

Systemtic Name: 9-[[4-[bis(azanyl)methylideneamino]sulfonylphenyl]amino]-7-methoxy-N-oxidanyl-acridin-3-amine oxide Openeye Name: 9-(4-guanidinosulfonylanilino)-N-hydroxy-7-methoxy-acridin-3-amine oxide CAS Name: 9-[4-(diaminomethylideneamino)sulfonylanilino]-N-hydroxy-7-methoxy-3-acridinamine oxide IUPAC Name: 9-[4-(diaminomethylideneamino)sulfonylanilino]-N-hydroxy-7-methoxyacridin-3-amine oxide Traditional Name: 9-(4-guanidinosulfonylanilino)-N-hydroxy-7-methoxy-acridin-3-amine oxide Formula: C21H20N6O5S MolecularWeight: 468.4857

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C3=C(C=C(C=C3)[NH+](O)[O-])N=C2C=C1)NC4=CC=C(C=C4)S(=O)(=O)N=C(N)N

Isomeric SMILES

COC1=CC2=C(C3=C(C=C(C=C3)[NH+](O)[O-])N=C2C=C1)NC4=CC=C(C=C4)S(=O)(=O)N=C(N)N

InChI

InChI=1S/C21H20N6O5S/c1-32-14-5-9-18-17(11-14)20(16-8-4-13(27(28)29)10-19(16)25-18)24-12-2-6-15(7-3-12)33(30,31)26-21(22)23/h2-11,27-28H,1H3,(H,24,25)(H4,22,23,26)