2-[2,5-dimethyl-3-[(4-oxidanylidene-2-phenyl-quinazolin-3-yl)iminomethyl]pyrrol-1-yl]-4,5-dimethyl-thiophene-3-carbonitrile

Systemtic Name: 2-[2,5-dimethyl-3-[(4-oxidanylidene-2-phenyl-quinazolin-3-yl)iminomethyl]pyrrol-1-yl]-4,5-dimethyl-thiophene-3-carbonitrile Openeye Name: 2-[2,5-dimethyl-3-[(4-oxo-2-phenyl-quinazolin-3-yl)iminomethyl]pyrrol-1-yl]-4,5-dimethyl-thiophene-3-carbonitrile CAS Name: 2-[2,5-dimethyl-3-[(4-oxo-2-phenyl-3-quinazolinyl)iminomethyl]-1-pyrrolyl]-4,5-dimethyl-3-thiophenecarbonitrile IUPAC Name: 2-[2,5-dimethyl-3-[(4-oxo-2-phenylquinazolin-3-yl)iminomethyl]pyrrol-1-yl]-4,5-dimethylthiophene-3-carbonitrile Traditional Name: 2-[3-[(4-keto-2-phenyl-quinazolin-3-yl)iminomethyl]-2,5-dimethyl-pyrrol-1-yl]-4,5-dimethyl-thiophene-3-carbonitrile Formula: C28H23N5OS MolecularWeight: 477.58012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C(=C(S2)C)C)C#N)C)C=NN3C(=NC4=CC=CC=C4C3=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(N1C2=C(C(=C(S2)C)C)C#N)C)C=NN3C(=NC4=CC=CC=C4C3=O)C5=CC=CC=C5

InChI

InChI=1S/C28H23N5OS/c1-17-14-22(19(3)32(17)28-24(15-29)18(2)20(4)35-28)16-30-33-26(21-10-6-5-7-11-21)31-25-13-9-8-12-23(25)27(33)34/h5-14,16H,1-4H3