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

Systemtic Name: 4-oxidanylidene-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-3H-phthalazine-1-carboxamide Openeye Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-oxo-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]-3H-phthalazine-1-carboxamide IUPAC Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-4-keto-3H-phthalazine-1-carboxamide Formula: C18H13N5O2S MolecularWeight: 363.39312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(S2)NC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(S2)NC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C18H13N5O2S/c24-16-13-9-5-4-8-12(13)15(21-22-16)17(25)19-18-23-20-14(26-18)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,22,24)(H,19,23,25)