2-butyl-3-methyl-4-oxidanylidene-1-phenyl-5-(4H-quinazolin-3-yl)indole-2-carbonitrile

Systemtic Name: 2-butyl-3-methyl-4-oxidanylidene-1-phenyl-5-(4H-quinazolin-3-yl)indole-2-carbonitrile Openeye Name: 2-butyl-3-methyl-4-oxo-1-phenyl-5-(4H-quinazolin-3-yl)indole-2-carbonitrile CAS Name: 2-butyl-3-methyl-4-oxo-1-phenyl-5-(4H-quinazolin-3-yl)-2-indolecarbonitrile IUPAC Name: 2-butyl-3-methyl-4-oxo-1-phenyl-5-(4H-quinazolin-3-yl)indole-2-carbonitrile Traditional Name: 2-butyl-4-keto-3-methyl-1-phenyl-5-(4H-quinazolin-3-yl)indole-2-carbonitrile Formula: C28H26N4O MolecularWeight: 434.53224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=C2C(=CC=C(C2=O)N3CC4=CC=CC=C4N=C3)N1C5=CC=CC=C5)C)C#N

Isomeric SMILES

CCCCC1(C(=C2C(=CC=C(C2=O)N3CC4=CC=CC=C4N=C3)N1C5=CC=CC=C5)C)C#N

InChI

InChI=1S/C28H26N4O/c1-3-4-16-28(18-29)20(2)26-24(32(28)22-11-6-5-7-12-22)14-15-25(27(26)33)31-17-21-10-8-9-13-23(21)30-19-31/h5-15,19H,3-4,16-17H2,1-2H3