ethyl 2-[2-acetamido-6-[4-[cyclohexyl(methyl)amino]-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-acetamido-6-[4-[cyclohexyl(methyl)amino]-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoate Openeye Name: ethyl 2-[2-acetamido-6-[4-[cyclohexyl(methyl)amino]-4-oxo-butoxy]-4H-quinazolin-3-yl]acetate CAS Name: 2-[2-acetamido-6-[4-[cyclohexyl(methyl)amino]-4-oxobutoxy]-4H-quinazolin-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-acetamido-6-[4-[cyclohexyl(methyl)amino]-4-oxobutoxy]-4H-quinazolin-3-yl]acetate Traditional Name: 2-[2-acetamido-6-[4-[cyclohexyl(methyl)amino]-4-keto-butoxy]-4H-quinazolin-3-yl]acetic acid ethyl ester Formula: C25H36N4O5 MolecularWeight: 472.57714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CC2=C(C=CC(=C2)OCCCC(=O)N(C)C3CCCCC3)N=C1NC(=O)C

Isomeric SMILES

CCOC(=O)CN1CC2=C(C=CC(=C2)OCCCC(=O)N(C)C3CCCCC3)N=C1NC(=O)C

InChI

InChI=1S/C25H36N4O5/c1-4-33-24(32)17-29-16-19-15-21(12-13-22(19)27-25(29)26-18(2)30)34-14-8-11-23(31)28(3)20-9-6-5-7-10-20/h12-13,15,20H,4-11,14,16-17H2,1-3H3,(H,26,27,30)