6-nitro-3-(5-phenylazanyl-1,3,4-thiadiazol-2-yl)chromen-2-one

Systemtic Name: 6-nitro-3-(5-phenylazanyl-1,3,4-thiadiazol-2-yl)chromen-2-one Openeye Name: 3-(5-anilino-1,3,4-thiadiazol-2-yl)-6-nitro-chromen-2-one CAS Name: 3-(5-anilino-1,3,4-thiadiazol-2-yl)-6-nitro-1-benzopyran-2-one IUPAC Name: 3-(5-anilino-1,3,4-thiadiazol-2-yl)-6-nitrochromen-2-one Traditional Name: 3-(5-anilino-1,3,4-thiadiazol-2-yl)-6-nitro-coumarin Formula: C17H10N4O4S MolecularWeight: 366.3507

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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

Isomeric SMILES

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

InChI

InChI=1S/C17H10N4O4S/c22-16-13(9-10-8-12(21(23)24)6-7-14(10)25-16)15-19-20-17(26-15)18-11-4-2-1-3-5-11/h1-9H,(H,18,20)