N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C

InChI

InChI=1S/C17H14N4O2S/c1-9-10(2)24-16(13(9)8-18)19-15(22)14-11-6-4-5-7-12(11)17(23)21(3)20-14/h4-7H,1-3H3,(H,19,22)