4-[(E)-(6-chloranyl-4-oxidanylidene-chromen-3-yl)methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one

Systemtic Name: 4-[(E)-(6-chloranyl-4-oxidanylidene-chromen-3-yl)methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one Openeye Name: 4-[(E)-(6-chloro-4-oxo-chromen-3-yl)methyleneamino]-3-thioxo-2H-1,2,4-triazin-5-one CAS Name: 4-[(E)-(6-chloro-4-oxo-1-benzopyran-3-yl)methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one IUPAC Name: 4-[(E)-(6-chloro-4-oxochromen-3-yl)methylideneamino]-3-sulfanylidene-2H-1,2,4-triazin-5-one Traditional Name: 4-[(E)-(6-chloro-4-keto-chromen-3-yl)methyleneamino]-3-thioxo-2H-1,2,4-triazin-5-one Formula: C13H7ClN4O3S MolecularWeight: 334.73768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(=O)C(=CO2)C=NN3C(=O)C=NNC3=S

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(=O)C(=CO2)/C=N/N3C(=O)C=NNC3=S

InChI

InChI=1S/C13H7ClN4O3S/c14-8-1-2-10-9(3-8)12(20)7(6-21-10)4-16-18-11(19)5-15-17-13(18)22/h1-6H,(H,17,22)/b16-4+