2-methylpropyl 2-[2-azanyl-6-[4-[hexyl(methyl)amino]-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoate

Systemtic Name: 2-methylpropyl 2-[2-azanyl-6-[4-[hexyl(methyl)amino]-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoate Openeye Name: isobutyl 2-[2-amino-6-[4-[hexyl(methyl)amino]-4-oxo-butoxy]-4H-quinazolin-3-yl]acetate CAS Name: 2-[2-amino-6-[4-[hexyl(methyl)amino]-4-oxobutoxy]-4H-quinazolin-3-yl]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[2-amino-6-[4-[hexyl(methyl)amino]-4-oxobutoxy]-4H-quinazolin-3-yl]acetate Traditional Name: 2-[2-amino-6-[4-[hexyl(methyl)amino]-4-keto-butoxy]-4H-quinazolin-3-yl]acetic acid isobutyl ester Formula: C25H40N4O4 MolecularWeight: 460.6095

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C)C(=O)CCCOC1=CC2=C(C=C1)N=C(N(C2)CC(=O)OCC(C)C)N

Isomeric SMILES

CCCCCCN(C)C(=O)CCCOC1=CC2=C(C=C1)N=C(N(C2)CC(=O)OCC(C)C)N

InChI

InChI=1S/C25H40N4O4/c1-5-6-7-8-13-28(4)23(30)10-9-14-32-21-11-12-22-20(15-21)16-29(25(26)27-22)17-24(31)33-18-19(2)3/h11-12,15,19H,5-10,13-14,16-18H2,1-4H3,(H2,26,27)