4-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]-N-propan-2-yl-piperazine-1-carboxamide

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]-N-propan-2-yl-piperazine-1-carboxamide Openeye Name: 4-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]-N-isopropyl-piperazine-1-carboxamide CAS Name: 4-[4-(1,3-benzodioxol-5-ylamino)-1-phthalazinyl]-N-propan-2-yl-1-piperazinecarboxamide IUPAC Name: 4-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]-N-propan-2-ylpiperazine-1-carboxamide Traditional Name: 4-[4-(1,3-benzodioxol-5-ylamino)phthalazin-1-yl]-N-isopropyl-piperazine-1-carboxamide Formula: C23H26N6O3 MolecularWeight: 434.49094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N1CCN(CC1)C2=NN=C(C3=CC=CC=C32)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C)NC(=O)N1CCN(CC1)C2=NN=C(C3=CC=CC=C32)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H26N6O3/c1-15(2)24-23(30)29-11-9-28(10-12-29)22-18-6-4-3-5-17(18)21(26-27-22)25-16-7-8-19-20(13-16)32-14-31-19/h3-8,13,15H,9-12,14H2,1-2H3,(H,24,30)(H,25,26)