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

Systemtic Name: N-[3-[2-(2,4-dimethylphenyl)-1,3-thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[3-[2-(2,4-dimethylphenyl)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[3-[2-(2,4-dimethylphenyl)-4-thiazolyl]-2,5-dimethyl-1-pyrrolyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[3-[2-(2,4-dimethylphenyl)-1,3-thiazol-4-yl]-2,5-dimethylpyrrol-1-yl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[3-[2-(2,4-dimethylphenyl)thiazol-4-yl]-2,5-dimethyl-pyrrol-1-yl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C27H25N5O2S MolecularWeight: 483.5847

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC(=CS2)C3=C(N(C(=C3)C)NC(=O)C4=NN(C(=O)C5=CC=CC=C54)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC(=CS2)C3=C(N(C(=C3)C)NC(=O)C4=NN(C(=O)C5=CC=CC=C54)C)C)C

InChI

InChI=1S/C27H25N5O2S/c1-15-10-11-19(16(2)12-15)26-28-23(14-35-26)22-13-17(3)32(18(22)4)30-25(33)24-20-8-6-7-9-21(20)27(34)31(5)29-24/h6-14H,1-5H3,(H,30,33)