methyl 3-azanyl-5-[[1-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperidin-4-yl]amino]-6-chloranyl-pyrazine-2-carboxylate

Systemtic Name: methyl 3-azanyl-5-[[1-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperidin-4-yl]amino]-6-chloranyl-pyrazine-2-carboxylate Openeye Name: methyl 3-amino-5-[[1-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-4-piperidyl]amino]-6-chloro-pyrazine-2-carboxylate CAS Name: 3-amino-5-[[1-(4-amino-6,7-dimethoxy-2-quinazolinyl)-4-piperidinyl]amino]-6-chloro-2-pyrazinecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-5-[[1-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperidin-4-yl]amino]-6-chloropyrazine-2-carboxylate Traditional Name: 3-amino-5-[[1-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-4-piperidyl]amino]-6-chloro-pyrazinic acid methyl ester Formula: C21H25ClN8O4 MolecularWeight: 488.9274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)NC4=NC(=C(N=C4Cl)C(=O)OC)N)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)NC4=NC(=C(N=C4Cl)C(=O)OC)N)N)OC

InChI

InChI=1S/C21H25ClN8O4/c1-32-13-8-11-12(9-14(13)33-2)26-21(29-17(11)23)30-6-4-10(5-7-30)25-19-16(22)27-15(18(24)28-19)20(31)34-3/h8-10H,4-7H2,1-3H3,(H2,23,26,29)(H3,24,25,28)