4-(7-azanyl-2-phenylazanyl-5-sulfanylidene-[1,3]thiazolo[5,4-d]pyrimidin-6-yl)-N-oxidanyl-benzeneamine oxide

Systemtic Name: 4-(7-azanyl-2-phenylazanyl-5-sulfanylidene-[1,3]thiazolo[5,4-d]pyrimidin-6-yl)-N-oxidanyl-benzeneamine oxide Openeye Name: 4-(7-amino-2-anilino-5-thioxo-thiazolo[5,4-d]pyrimidin-6-yl)-N-hydroxy-benzeneamine oxide CAS Name: 4-(7-amino-2-anilino-5-sulfanylidene-6-thiazolo[5,4-d]pyrimidinyl)-N-hydroxybenzeneamine oxide IUPAC Name: 4-(7-amino-2-anilino-5-sulfanylidene-[1,3]thiazolo[5,4-d]pyrimidin-6-yl)-N-hydroxybenzeneamine oxide Traditional Name: 4-(7-amino-2-anilino-5-thioxo-thiazolo[5,4-d]pyrimidin-6-yl)-N-hydroxy-benzeneamine oxide Formula: C17H14N6O2S2 MolecularWeight: 398.46206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC3=C(N(C(=S)N=C3S2)C4=CC=C(C=C4)[NH+](O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC3=C(N(C(=S)N=C3S2)C4=CC=C(C=C4)[NH+](O)[O-])N

InChI

InChI=1S/C17H14N6O2S2/c18-14-13-15(27-16(20-13)19-10-4-2-1-3-5-10)21-17(26)22(14)11-6-8-12(9-7-11)23(24)25/h1-9,23-24H,18H2,(H,19,20)