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

Systemtic Name: phenyl 2-[2-azanyl-6-[4-[cyclohexyl(methyl)amino]-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoate Openeye Name: phenyl 2-[2-amino-6-[4-[cyclohexyl(methyl)amino]-4-oxo-butoxy]-4H-quinazolin-3-yl]acetate CAS Name: 2-[2-amino-6-[4-[cyclohexyl(methyl)amino]-4-oxobutoxy]-4H-quinazolin-3-yl]acetic acid phenyl ester IUPAC Name: phenyl 2-[2-amino-6-[4-[cyclohexyl(methyl)amino]-4-oxobutoxy]-4H-quinazolin-3-yl]acetate Traditional Name: 2-[2-amino-6-[4-[cyclohexyl(methyl)amino]-4-keto-butoxy]-4H-quinazolin-3-yl]acetic acid phenyl ester Formula: C27H34N4O4 MolecularWeight: 478.58326

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)CCCOC2=CC3=C(C=C2)N=C(N(C3)CC(=O)OC4=CC=CC=C4)N

Isomeric SMILES

CN(C1CCCCC1)C(=O)CCCOC2=CC3=C(C=C2)N=C(N(C3)CC(=O)OC4=CC=CC=C4)N

InChI

InChI=1S/C27H34N4O4/c1-30(21-9-4-2-5-10-21)25(32)13-8-16-34-23-14-15-24-20(17-23)18-31(27(28)29-24)19-26(33)35-22-11-6-3-7-12-22/h3,6-7,11-12,14-15,17,21H,2,4-5,8-10,13,16,18-19H2,1H3,(H2,28,29)