2-[2,3-bis(bromanyl)-4-[(2-butyl-4-oxidanylidene-quinazolin-3-yl)methyl]indol-1-yl]benzenecarbonitrile

Systemtic Name: 2-[2,3-bis(bromanyl)-4-[(2-butyl-4-oxidanylidene-quinazolin-3-yl)methyl]indol-1-yl]benzenecarbonitrile Openeye Name: 2-[2,3-dibromo-4-[(2-butyl-4-oxo-quinazolin-3-yl)methyl]indol-1-yl]benzonitrile CAS Name: 2-[2,3-dibromo-4-[(2-butyl-4-oxo-3-quinazolinyl)methyl]-1-indolyl]benzonitrile IUPAC Name: 2-[2,3-dibromo-4-[(2-butyl-4-oxoquinazolin-3-yl)methyl]indol-1-yl]benzonitrile Traditional Name: 2-[2,3-dibromo-4-[(2-butyl-4-keto-quinazolin-3-yl)methyl]indol-1-yl]benzonitrile Formula: C28H22Br2N4O MolecularWeight: 590.30848

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2C(=O)N1CC3=C4C(=CC=C3)N(C(=C4Br)Br)C5=CC=CC=C5C#N

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2C(=O)N1CC3=C4C(=CC=C3)N(C(=C4Br)Br)C5=CC=CC=C5C#N

InChI

InChI=1S/C28H22Br2N4O/c1-2-3-15-24-32-21-12-6-5-11-20(21)28(35)33(24)17-19-10-8-14-23-25(19)26(29)27(30)34(23)22-13-7-4-9-18(22)16-31/h4-14H,2-3,15,17H2,1H3