ethyl 4-[1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl-(3-methylbutyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[1-[3-(3,4-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl-(3-methylbutyl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[1-[3-(3,4-dimethylphenyl)-4-oxo-quinazolin-2-yl]ethyl-isopentyl-amino]-4-oxo-butanoate CAS Name: 4-[1-[3-(3,4-dimethylphenyl)-4-oxo-2-quinazolinyl]ethyl-(3-methylbutyl)amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[1-[3-(3,4-dimethylphenyl)-4-oxoquinazolin-2-yl]ethyl-(3-methylbutyl)amino]-4-oxobutanoate Traditional Name: 4-[1-[3-(3,4-dimethylphenyl)-4-keto-quinazolin-2-yl]ethyl-isoamyl-amino]-4-keto-butyric acid ethyl ester Formula: C29H37N3O4 MolecularWeight: 491.62178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N(CCC(C)C)C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)CCC(=O)N(CCC(C)C)C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C29H37N3O4/c1-7-36-27(34)15-14-26(33)31(17-16-19(2)3)22(6)28-30-25-11-9-8-10-24(25)29(35)32(28)23-13-12-20(4)21(5)18-23/h8-13,18-19,22H,7,14-17H2,1-6H3