N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-4-keto-3H-phthalazine-1-carboxamide Formula: C13H11N5O2S2 MolecularWeight: 333.38874

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C13H11N5O2S2/c1-2-21-13-18-17-12(22-13)14-11(20)9-7-5-3-4-6-8(7)10(19)16-15-9/h3-6H,2H2,1H3,(H,16,19)(H,14,17,20)