N-[(4-chlorophenyl)methyl]-1-methyl-4-oxidanylidene-6-(3-oxidanylprop-1-ynyl)pyrido[3,4-c]pyridazine-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-methyl-4-oxidanylidene-6-(3-oxidanylprop-1-ynyl)pyrido[3,4-c]pyridazine-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-6-(3-hydroxyprop-1-ynyl)-1-methyl-4-oxo-pyrido[3,4-c]pyridazine-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-6-(3-hydroxyprop-1-ynyl)-1-methyl-4-oxo-3-pyrido[3,4-c]pyridazinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-6-(3-hydroxyprop-1-ynyl)-1-methyl-4-oxopyrido[3,4-c]pyridazine-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-6-(3-hydroxyprop-1-ynyl)-4-keto-1-methyl-pyrido[3,4-c]pyridazine-3-carboxamide Formula: C19H15ClN4O3 MolecularWeight: 382.8004

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(N=C2)C#CCO)C(=O)C(=N1)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C2=C(C=C(N=C2)C#CCO)C(=O)C(=N1)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H15ClN4O3/c1-24-16-11-21-14(3-2-8-25)9-15(16)18(26)17(23-24)19(27)22-10-12-4-6-13(20)7-5-12/h4-7,9,11,25H,8,10H2,1H3,(H,22,27)