propan-2-yl 2-[2-azanyl-7-[6-[cyclohexyl(propyl)amino]-6-oxidanylidene-hexanoyl]-4H-quinazolin-3-yl]ethanoate

Systemtic Name: propan-2-yl 2-[2-azanyl-7-[6-[cyclohexyl(propyl)amino]-6-oxidanylidene-hexanoyl]-4H-quinazolin-3-yl]ethanoate Openeye Name: isopropyl 2-[2-amino-7-[6-[cyclohexyl(propyl)amino]-6-oxo-hexanoyl]-4H-quinazolin-3-yl]acetate CAS Name: 2-[2-amino-7-[6-[cyclohexyl(propyl)amino]-1,6-dioxohexyl]-4H-quinazolin-3-yl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[2-amino-7-[6-[cyclohexyl(propyl)amino]-6-oxohexanoyl]-4H-quinazolin-3-yl]acetate Traditional Name: 2-[2-amino-7-[6-[cyclohexyl(propyl)amino]-6-keto-hexanoyl]-4H-quinazolin-3-yl]acetic acid isopropyl ester Formula: C28H42N4O4 MolecularWeight: 498.65748

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CCCCC1)C(=O)CCCCC(=O)C2=CC3=C(CN(C(=N3)N)CC(=O)OC(C)C)C=C2

Isomeric SMILES

CCCN(C1CCCCC1)C(=O)CCCCC(=O)C2=CC3=C(CN(C(=N3)N)CC(=O)OC(C)C)C=C2

InChI

InChI=1S/C28H42N4O4/c1-4-16-32(23-10-6-5-7-11-23)26(34)13-9-8-12-25(33)21-14-15-22-18-31(19-27(35)36-20(2)3)28(29)30-24(22)17-21/h14-15,17,20,23H,4-13,16,18-19H2,1-3H3,(H2,29,30)