3-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-1H-quinazoline-2,4-dione Openeye Name: 3-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-1H-quinazoline-2,4-dione CAS Name: 3-[[1-(4-butylphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-1H-quinazoline-2,4-dione IUPAC Name: 3-[[1-(4-butylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-1H-quinazoline-2,4-dione Traditional Name: 3-[[1-(4-butylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-1H-quinazoline-2,4-quinone Formula: C25H26N4O2 MolecularWeight: 414.49954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=CC(=C2C)C=NN3C(=O)C4=CC=CC=C4NC3=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=CC(=C2C)C=NN3C(=O)C4=CC=CC=C4NC3=O)C

InChI

InChI=1S/C25H26N4O2/c1-4-5-8-19-11-13-21(14-12-19)28-17(2)15-20(18(28)3)16-26-29-24(30)22-9-6-7-10-23(22)27-25(29)31/h6-7,9-16H,4-5,8H2,1-3H3,(H,27,31)