4-chloranyl-2-[(Z)-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)iminomethyl]-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-[(Z)-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)iminomethyl]-6-nitro-phenolate Openeye Name: 4-chloro-2-[(Z)-(6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)iminomethyl]-6-nitro-phenolate CAS Name: 4-chloro-2-[(Z)-(6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)iminomethyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-[(Z)-(6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)iminomethyl]-6-nitrophenolate Traditional Name: 4-chloro-2-[(Z)-(6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl)iminomethyl]-6-nitro-phenolate Formula: C15H10ClN4O4S- MolecularWeight: 377.7823

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)/N=C\C3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C15H11ClN4O4S/c1-2-10-5-11-14(25-10)17-7-19(15(11)22)18-6-8-3-9(16)4-12(13(8)21)20(23)24/h3-7,21H,2H2,1H3/p-1/b18-6-