3-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-phenyl-quinazolin-4-one

Systemtic Name: 3-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-phenyl-quinazolin-4-one Openeye Name: 3-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-phenyl-quinazolin-4-one CAS Name: 3-[[1-(4-butylphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-2-phenyl-4-quinazolinone IUPAC Name: 3-[[1-(4-butylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-2-phenylquinazolin-4-one Traditional Name: 3-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-phenyl-quinazolin-4-one Formula: C31H30N4O MolecularWeight: 474.5961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=CC(=C2C)C=NN3C(=NC4=CC=CC=C4C3=O)C5=CC=CC=C5)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=CC(=C2C)C=NN3C(=NC4=CC=CC=C4C3=O)C5=CC=CC=C5)C

InChI

InChI=1S/C31H30N4O/c1-4-5-11-24-16-18-27(19-17-24)34-22(2)20-26(23(34)3)21-32-35-30(25-12-7-6-8-13-25)33-29-15-10-9-14-28(29)31(35)36/h6-10,12-21H,4-5,11H2,1-3H3