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

Systemtic Name: N-[(Z)-1-(5-bromanylthiophen-2-yl)ethylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(Z)-1-(5-bromo-2-thienyl)ethylideneamino]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(Z)-1-(5-bromo-2-thiophenyl)ethylideneamino]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(Z)-1-(5-bromothiophen-2-yl)ethylideneamino]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(Z)-1-(5-bromo-2-thienyl)ethylideneamino]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C16H13BrN4O2S MolecularWeight: 405.26902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13BrN4O2S/c1-9(12-7-8-13(17)24-12)18-19-15(22)14-10-5-3-4-6-11(10)16(23)21(2)20-14/h3-8H,1-2H3,(H,19,22)/b18-9-