[4-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]piperazin-1-yl]-cyclopropyl-methanone

Systemtic Name: [4-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]piperazin-1-yl]-cyclopropyl-methanone Openeye Name: [4-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]piperazin-1-yl]-cyclopropyl-methanone CAS Name: [4-[4-(1,3-benzodioxol-5-ylamino)-1-phthalazinyl]-1-piperazinyl]-cyclopropylmethanone IUPAC Name: [4-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]piperazin-1-yl]-cyclopropylmethanone Traditional Name: [4-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]piperazino]-cyclopropyl-methanone Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)NC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)NC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C23H23N5O3/c29-23(15-5-6-15)28-11-9-27(10-12-28)22-18-4-2-1-3-17(18)21(25-26-22)24-16-7-8-19-20(13-16)31-14-30-19/h1-4,7-8,13,15H,5-6,9-12,14H2,(H,24,25)