N-[2,5-dimethyl-3-[2-(pyridin-2-ylamino)-1,3-thiazol-4-yl]pyrrol-1-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[2,5-dimethyl-3-[2-(pyridin-2-ylamino)-1,3-thiazol-4-yl]pyrrol-1-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2,5-dimethyl-3-[2-(2-pyridylamino)thiazol-4-yl]pyrrol-1-yl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2,5-dimethyl-3-[2-(2-pyridinylamino)-4-thiazolyl]-1-pyrrolyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2,5-dimethyl-3-[2-(pyridin-2-ylamino)-1,3-thiazol-4-yl]pyrrol-1-yl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2,5-dimethyl-3-[2-(2-pyridylamino)thiazol-4-yl]pyrrol-1-yl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C24H21N7O2S MolecularWeight: 471.53424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C)C4=CSC(=N4)NC5=CC=CC=N5

Isomeric SMILES

CC1=CC(=C(N1NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C)C4=CSC(=N4)NC5=CC=CC=N5

InChI

InChI=1S/C24H21N7O2S/c1-14-12-18(19-13-34-24(26-19)27-20-10-6-7-11-25-20)15(2)31(14)29-22(32)21-16-8-4-5-9-17(16)23(33)30(3)28-21/h4-13H,1-3H3,(H,29,32)(H,25,26,27)