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

Systemtic Name: N-[3-[2-(furan-2-ylmethylamino)-1,3-thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[3-[2-(2-furylmethylamino)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[3-[2-(2-furanylmethylamino)-4-thiazolyl]-2,5-dimethyl-1-pyrrolyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[3-[2-(furan-2-ylmethylamino)-1,3-thiazol-4-yl]-2,5-dimethylpyrrol-1-yl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[3-[2-(2-furfurylamino)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C24H22N6O3S MolecularWeight: 474.53488

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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)NCC5=CC=CO5

Isomeric SMILES

CC1=CC(=C(N1NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)C)C4=CSC(=N4)NCC5=CC=CO5

InChI

InChI=1S/C24H22N6O3S/c1-14-11-19(20-13-34-24(26-20)25-12-16-7-6-10-33-16)15(2)30(14)28-22(31)21-17-8-4-5-9-18(17)23(32)29(3)27-21/h4-11,13H,12H2,1-3H3,(H,25,26)(H,28,31)