2,2-dimethylpropyl 2-[2-azanyl-7-[4-[(1-methylpiperazin-2-yl)amino]-4-oxidanylidene-butanoyl]-4H-quinazolin-3-yl]ethanoate

Systemtic Name: 2,2-dimethylpropyl 2-[2-azanyl-7-[4-[(1-methylpiperazin-2-yl)amino]-4-oxidanylidene-butanoyl]-4H-quinazolin-3-yl]ethanoate Openeye Name: 2,2-dimethylpropyl 2-[2-amino-7-[4-[(1-methylpiperazin-2-yl)amino]-4-oxo-butanoyl]-4H-quinazolin-3-yl]acetate CAS Name: 2-[2-amino-7-[4-[(1-methyl-2-piperazinyl)amino]-1,4-dioxobutyl]-4H-quinazolin-3-yl]acetic acid 2,2-dimethylpropyl ester IUPAC Name: 2,2-dimethylpropyl 2-[2-amino-7-[4-[(1-methylpiperazin-2-yl)amino]-4-oxobutanoyl]-4H-quinazolin-3-yl]acetate Traditional Name: 2-[2-amino-7-[4-keto-4-[(1-methylpiperazin-2-yl)amino]butanoyl]-4H-quinazolin-3-yl]acetic acid neopentyl ester Formula: C24H36N6O4 MolecularWeight: 472.58044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COC(=O)CN1CC2=C(C=C(C=C2)C(=O)CCC(=O)NC3CNCCN3C)N=C1N

Isomeric SMILES

CC(C)(C)COC(=O)CN1CC2=C(C=C(C=C2)C(=O)CCC(=O)NC3CNCCN3C)N=C1N

InChI

InChI=1S/C24H36N6O4/c1-24(2,3)15-34-22(33)14-30-13-17-6-5-16(11-18(17)27-23(30)25)19(31)7-8-21(32)28-20-12-26-9-10-29(20)4/h5-6,11,20,26H,7-10,12-15H2,1-4H3,(H2,25,27)(H,28,32)