5-(3-imidazol-1-ylpropylamino)-2-(3-methyl-4-oxidanylidene-2-phenyl-chromen-8-yl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(3-imidazol-1-ylpropylamino)-2-(3-methyl-4-oxidanylidene-2-phenyl-chromen-8-yl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-(3-imidazol-1-ylpropylamino)-2-(3-methyl-4-oxo-2-phenyl-chromen-8-yl)oxazole-4-carbonitrile CAS Name: 5-[3-(1-imidazolyl)propylamino]-2-(3-methyl-4-oxo-2-phenyl-1-benzopyran-8-yl)-4-oxazolecarbonitrile IUPAC Name: 5-(3-imidazol-1-ylpropylamino)-2-(3-methyl-4-oxo-2-phenylchromen-8-yl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(3-imidazol-1-ylpropylamino)-2-(4-keto-3-methyl-2-phenyl-chromen-8-yl)oxazole-4-carbonitrile Formula: C26H21N5O3 MolecularWeight: 451.47664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2C3=NC(=C(O3)NCCCN4C=CN=C4)C#N)C5=CC=CC=C5

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2C3=NC(=C(O3)NCCCN4C=CN=C4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C26H21N5O3/c1-17-22(32)19-9-5-10-20(24(19)33-23(17)18-7-3-2-4-8-18)25-30-21(15-27)26(34-25)29-11-6-13-31-14-12-28-16-31/h2-5,7-10,12,14,16,29H,6,11,13H2,1H3