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

Systemtic Name: 2-phenylpropyl 2-[2-azanyl-6-[4-[cyclohexyl(methyl)amino]-4-oxidanylidene-butoxy]-4H-quinazolin-3-yl]ethanoate Openeye Name: 2-phenylpropyl 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 2-phenylpropyl ester IUPAC Name: 2-phenylpropyl 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 2-phenylpropyl ester Formula: C30H40N4O4 MolecularWeight: 520.663

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)CN1CC2=C(C=CC(=C2)OCCCC(=O)N(C)C3CCCCC3)N=C1N)C4=CC=CC=C4

Isomeric SMILES

CC(COC(=O)CN1CC2=C(C=CC(=C2)OCCCC(=O)N(C)C3CCCCC3)N=C1N)C4=CC=CC=C4

InChI

InChI=1S/C30H40N4O4/c1-22(23-10-5-3-6-11-23)21-38-29(36)20-34-19-24-18-26(15-16-27(24)32-30(34)31)37-17-9-14-28(35)33(2)25-12-7-4-8-13-25/h3,5-6,10-11,15-16,18,22,25H,4,7-9,12-14,17,19-21H2,1-2H3,(H2,31,32)