5-[4-[(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl]piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-[(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl]piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-[(7-bromo-2-oxo-chromen-4-yl)methyl]piperazin-1-yl]-2-cyclopropyl-oxazole-4-carbonitrile CAS Name: 5-[4-[(7-bromo-2-oxo-1-benzopyran-4-yl)methyl]-1-piperazinyl]-2-cyclopropyl-4-oxazolecarbonitrile IUPAC Name: 5-[4-[(7-bromo-2-oxochromen-4-yl)methyl]piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-[(7-bromo-2-keto-chromen-4-yl)methyl]piperazino]-2-cyclopropyl-oxazole-4-carbonitrile Formula: C21H19BrN4O3 MolecularWeight: 455.30456

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=C(O2)N3CCN(CC3)CC4=CC(=O)OC5=C4C=CC(=C5)Br)C#N

Isomeric SMILES

C1CC1C2=NC(=C(O2)N3CCN(CC3)CC4=CC(=O)OC5=C4C=CC(=C5)Br)C#N

InChI

InChI=1S/C21H19BrN4O3/c22-15-3-4-16-14(9-19(27)28-18(16)10-15)12-25-5-7-26(8-6-25)21-17(11-23)24-20(29-21)13-1-2-13/h3-4,9-10,13H,1-2,5-8,12H2