N-(1,3-benzodioxol-5-ylmethyl)-4-imidazol-1-yl-7-methyl-phthalazin-1-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-imidazol-1-yl-7-methyl-phthalazin-1-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-imidazol-1-yl-7-methyl-phthalazin-1-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(1-imidazolyl)-7-methyl-1-phthalazinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-imidazol-1-yl-7-methylphthalazin-1-amine Traditional Name: (4-imidazol-1-yl-7-methyl-phthalazin-1-yl)-piperonyl-amine Formula: C20H17N5O2 MolecularWeight: 359.38128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NN=C2NCC3=CC4=C(C=C3)OCO4)N5C=CN=C5

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NN=C2NCC3=CC4=C(C=C3)OCO4)N5C=CN=C5

InChI

InChI=1S/C20H17N5O2/c1-13-2-4-15-16(8-13)19(23-24-20(15)25-7-6-21-11-25)22-10-14-3-5-17-18(9-14)27-12-26-17/h2-9,11H,10,12H2,1H3,(H,22,23)