N-[3-methyl-4-(1,2,3,4-tetrazol-1-yl)phenyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[3-methyl-4-(1,2,3,4-tetrazol-1-yl)phenyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[3-methyl-4-(tetrazol-1-yl)phenyl]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[3-methyl-4-(1-tetrazolyl)phenyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[3-methyl-4-(tetrazol-1-yl)phenyl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-[3-methyl-4-(tetrazol-1-yl)phenyl]phthalazine-1-carboxamide Formula: C22H23N7O2 MolecularWeight: 417.46372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3)N4C=NN=N4)C

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3)N4C=NN=N4)C

InChI

InChI=1S/C22H23N7O2/c1-3-4-7-12-28-22(31)18-9-6-5-8-17(18)20(25-28)21(30)24-16-10-11-19(15(2)13-16)29-14-23-26-27-29/h5-6,8-11,13-14H,3-4,7,12H2,1-2H3,(H,24,30)