3-[5-[(2-fluorophenyl)amino]-1,3,4-thiadiazol-2-yl]-6-nitro-chromen-2-one

Systemtic Name: 3-[5-[(2-fluorophenyl)amino]-1,3,4-thiadiazol-2-yl]-6-nitro-chromen-2-one Openeye Name: 3-[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]-6-nitro-chromen-2-one CAS Name: 3-[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]-6-nitro-1-benzopyran-2-one IUPAC Name: 3-[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]-6-nitrochromen-2-one Traditional Name: 3-[5-(2-fluoroanilino)-1,3,4-thiadiazol-2-yl]-6-nitro-coumarin Formula: C17H9FN4O4S MolecularWeight: 384.341163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=NN=C(S2)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O)F

Isomeric SMILES

C1=CC=C(C(=C1)NC2=NN=C(S2)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O)F

InChI

InChI=1S/C17H9FN4O4S/c18-12-3-1-2-4-13(12)19-17-21-20-15(27-17)11-8-9-7-10(22(24)25)5-6-14(9)26-16(11)23/h1-8H,(H,19,21)