2-methylpropyl 2-[6-[4-(dipentylamino)-4-oxidanylidene-butoxy]-2-(propanoylamino)-4H-quinazolin-3-yl]ethanoate

Systemtic Name: 2-methylpropyl 2-[6-[4-(dipentylamino)-4-oxidanylidene-butoxy]-2-(propanoylamino)-4H-quinazolin-3-yl]ethanoate Openeye Name: isobutyl 2-[6-[4-(dipentylamino)-4-oxo-butoxy]-2-(propanoylamino)-4H-quinazolin-3-yl]acetate CAS Name: 2-[6-[4-(dipentylamino)-4-oxobutoxy]-2-(1-oxopropylamino)-4H-quinazolin-3-yl]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[6-[4-(dipentylamino)-4-oxobutoxy]-2-(propanoylamino)-4H-quinazolin-3-yl]acetate Traditional Name: 2-[6-[4-(diamylamino)-4-keto-butoxy]-2-propionamido-4H-quinazolin-3-yl]acetic acid isobutyl ester Formula: C31H50N4O5 MolecularWeight: 558.7525

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=O)CCCOC1=CC2=C(C=C1)N=C(N(C2)CC(=O)OCC(C)C)NC(=O)CC

Isomeric SMILES

CCCCCN(CCCCC)C(=O)CCCOC1=CC2=C(C=C1)N=C(N(C2)CC(=O)OCC(C)C)NC(=O)CC

InChI

InChI=1S/C31H50N4O5/c1-6-9-11-17-34(18-12-10-7-2)29(37)14-13-19-39-26-15-16-27-25(20-26)21-35(22-30(38)40-23-24(4)5)31(32-27)33-28(36)8-3/h15-16,20,24H,6-14,17-19,21-23H2,1-5H3,(H,32,33,36)