N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[5-[(4-fluorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[5-[(4-fluorobenzyl)thio]-1,3,4-thiadiazol-2-yl]-4-keto-3H-phthalazine-1-carboxamide Formula: C18H12FN5O2S2 MolecularWeight: 413.448583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)F

InChI

InChI=1S/C18H12FN5O2S2/c19-11-7-5-10(6-8-11)9-27-18-24-23-17(28-18)20-16(26)14-12-3-1-2-4-13(12)15(25)22-21-14/h1-8H,9H2,(H,22,25)(H,20,23,26)