propan-2-yl 2-[8-[4-(dicyclohexylamino)-4-oxidanylidene-butoxy]-2-(2-phenylethanoylamino)-4H-quinazolin-3-yl]ethanoate

Systemtic Name: propan-2-yl 2-[8-[4-(dicyclohexylamino)-4-oxidanylidene-butoxy]-2-(2-phenylethanoylamino)-4H-quinazolin-3-yl]ethanoate Openeye Name: isopropyl 2-[8-[4-(dicyclohexylamino)-4-oxo-butoxy]-2-[(2-phenylacetyl)amino]-4H-quinazolin-3-yl]acetate CAS Name: 2-[8-[4-(dicyclohexylamino)-4-oxobutoxy]-2-[(1-oxo-2-phenylethyl)amino]-4H-quinazolin-3-yl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[8-[4-(dicyclohexylamino)-4-oxobutoxy]-2-[(2-phenylacetyl)amino]-4H-quinazolin-3-yl]acetate Traditional Name: 2-[8-[4-(dicyclohexylamino)-4-keto-butoxy]-2-[(2-phenylacetyl)amino]-4H-quinazolin-3-yl]acetic acid isopropyl ester Formula: C37H50N4O5 MolecularWeight: 630.8167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CN1CC2=C(C(=CC=C2)OCCCC(=O)N(C3CCCCC3)C4CCCCC4)N=C1NC(=O)CC5=CC=CC=C5

Isomeric SMILES

CC(C)OC(=O)CN1CC2=C(C(=CC=C2)OCCCC(=O)N(C3CCCCC3)C4CCCCC4)N=C1NC(=O)CC5=CC=CC=C5

InChI

InChI=1S/C37H50N4O5/c1-27(2)46-35(44)26-40-25-29-16-12-21-32(36(29)39-37(40)38-33(42)24-28-14-6-3-7-15-28)45-23-13-22-34(43)41(30-17-8-4-9-18-30)31-19-10-5-11-20-31/h3,6-7,12,14-16,21,27,30-31H,4-5,8-11,13,17-20,22-26H2,1-2H3,(H,38,39,42)