3-methylbutyl 2-[2-azanyl-6-[4-[methyl(pentyl)amino]-4-oxidanylidene-butanoyl]-4H-quinazolin-3-yl]ethanoate

Systemtic Name: 3-methylbutyl 2-[2-azanyl-6-[4-[methyl(pentyl)amino]-4-oxidanylidene-butanoyl]-4H-quinazolin-3-yl]ethanoate Openeye Name: isopentyl 2-[2-amino-6-[4-[methyl(pentyl)amino]-4-oxo-butanoyl]-4H-quinazolin-3-yl]acetate CAS Name: 2-[2-amino-6-[4-[methyl(pentyl)amino]-1,4-dioxobutyl]-4H-quinazolin-3-yl]acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[2-amino-6-[4-[methyl(pentyl)amino]-4-oxobutanoyl]-4H-quinazolin-3-yl]acetate Traditional Name: 2-[2-amino-6-[4-[amyl(methyl)amino]-4-keto-butanoyl]-4H-quinazolin-3-yl]acetic acid isoamyl ester Formula: C25H38N4O4 MolecularWeight: 458.59362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C)C(=O)CCC(=O)C1=CC2=C(C=C1)N=C(N(C2)CC(=O)OCCC(C)C)N

Isomeric SMILES

CCCCCN(C)C(=O)CCC(=O)C1=CC2=C(C=C1)N=C(N(C2)CC(=O)OCCC(C)C)N

InChI

InChI=1S/C25H38N4O4/c1-5-6-7-13-28(4)23(31)11-10-22(30)19-8-9-21-20(15-19)16-29(25(26)27-21)17-24(32)33-14-12-18(2)3/h8-9,15,18H,5-7,10-14,16-17H2,1-4H3,(H2,26,27)