N-[(Z)-1-(5-bromanylthiophen-2-yl)ethylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-1-(5-bromanylthiophen-2-yl)ethylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(Z)-1-(5-bromo-2-thienyl)ethylideneamino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(Z)-1-(5-bromo-2-thiophenyl)ethylideneamino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(Z)-1-(5-bromothiophen-2-yl)ethylideneamino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-[(Z)-1-(5-bromo-2-thienyl)ethylideneamino]-4-keto-3H-phthalazine-1-carboxamide Formula: C15H11BrN4O2S MolecularWeight: 391.24244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NNC(=O)C2=CC=CC=C21)C3=CC=C(S3)Br

Isomeric SMILES

C/C(=N/NC(=O)C1=NNC(=O)C2=CC=CC=C21)/C3=CC=C(S3)Br

InChI

InChI=1S/C15H11BrN4O2S/c1-8(11-6-7-12(16)23-11)17-20-15(22)13-9-4-2-3-5-10(9)14(21)19-18-13/h2-7H,1H3,(H,19,21)(H,20,22)/b17-8-