phenethyl 2-[2-benzamido-6-[4-[cycloheptyl(methyl)amino]-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoate

Systemtic Name: phenethyl 2-[2-benzamido-6-[4-[cycloheptyl(methyl)amino]-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoate Openeye Name: phenethyl 2-[2-benzamido-6-[4-[cycloheptyl(methyl)amino]-4-oxo-butoxy]-4H-quinazolin-3-yl]acetate CAS Name: 2-[2-benzamido-6-[4-[cycloheptyl(methyl)amino]-4-oxobutoxy]-4H-quinazolin-3-yl]acetic acid phenethyl ester IUPAC Name: phenethyl 2-[2-benzamido-6-[4-[cycloheptyl(methyl)amino]-4-oxobutoxy]-4H-quinazolin-3-yl]acetate Traditional Name: 2-[2-benzamido-6-[4-[cycloheptyl(methyl)amino]-4-keto-butoxy]-4H-quinazolin-3-yl]acetic acid phenethyl ester Formula: C37H44N4O5 MolecularWeight: 624.76906

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCCC1)C(=O)CCCOC2=CC3=C(C=C2)N=C(N(C3)CC(=O)OCCC4=CC=CC=C4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

CN(C1CCCCCC1)C(=O)CCCOC2=CC3=C(C=C2)N=C(N(C3)CC(=O)OCCC4=CC=CC=C4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C37H44N4O5/c1-40(31-17-10-2-3-11-18-31)34(42)19-12-23-45-32-20-21-33-30(25-32)26-41(27-35(43)46-24-22-28-13-6-4-7-14-28)37(38-33)39-36(44)29-15-8-5-9-16-29/h4-9,13-16,20-21,25,31H,2-3,10-12,17-19,22-24,26-27H2,1H3,(H,38,39,44)