4-[(4-methyl-1H-indol-3-yl)methyl]-2-(2H-1,2,3,4-tetrazol-5-ylmethyl)phthalazin-1-one

Systemtic Name: 4-[(4-methyl-1H-indol-3-yl)methyl]-2-(2H-1,2,3,4-tetrazol-5-ylmethyl)phthalazin-1-one Openeye Name: 4-[(4-methyl-1H-indol-3-yl)methyl]-2-(2H-tetrazol-5-ylmethyl)phthalazin-1-one CAS Name: 4-[(4-methyl-1H-indol-3-yl)methyl]-2-(2H-tetrazol-5-ylmethyl)-1-phthalazinone IUPAC Name: 4-[(4-methyl-1H-indol-3-yl)methyl]-2-(2H-tetrazol-5-ylmethyl)phthalazin-1-one Traditional Name: 4-[(4-methyl-1H-indol-3-yl)methyl]-2-(2H-tetrazol-5-ylmethyl)phthalazin-1-one Formula: C20H17N7O MolecularWeight: 371.39528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)NC=C2CC3=NN(C(=O)C4=CC=CC=C43)CC5=NNN=N5

Isomeric SMILES

CC1=C2C(=CC=C1)NC=C2CC3=NN(C(=O)C4=CC=CC=C43)CC5=NNN=N5

InChI

InChI=1S/C20H17N7O/c1-12-5-4-8-16-19(12)13(10-21-16)9-17-14-6-2-3-7-15(14)20(28)27(24-17)11-18-22-25-26-23-18/h2-8,10,21H,9,11H2,1H3,(H,22,23,25,26)