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

Systemtic Name: 3-ethyl-N-[4-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-1,3-thiazol-2-yl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-ethyl-N-[4-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]thiazol-2-yl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-ethyl-N-[4-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-thiazolyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-ethyl-N-[4-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]-1,3-thiazol-2-yl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-ethyl-4-keto-N-[4-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]thiazol-2-yl]phthalazine-1-carboxamide Formula: C27H25N5O3S MolecularWeight: 499.5841

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=C(N(C(=C4)C)C5=CC=C(C=C5)OC)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=NC(=CS3)C4=C(N(C(=C4)C)C5=CC=C(C=C5)OC)C

InChI

InChI=1S/C27H25N5O3S/c1-5-31-26(34)21-9-7-6-8-20(21)24(30-31)25(33)29-27-28-23(15-36-27)22-14-16(2)32(17(22)3)18-10-12-19(35-4)13-11-18/h6-15H,5H2,1-4H3,(H,28,29,33)