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

Systemtic Name: methyl 3-azanyl-5-[[1-(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)piperidin-4-yl]amino]pyrazine-2-carboxylate Openeye Name: methyl 3-amino-5-[[1-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-4-piperidyl]amino]pyrazine-2-carboxylate CAS Name: 3-amino-5-[[1-(4-amino-6,7-dimethoxy-2-quinazolinyl)-4-piperidinyl]amino]-2-pyrazinecarboxylic acid methyl ester IUPAC Name: methyl 3-amino-5-[[1-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperidin-4-yl]amino]pyrazine-2-carboxylate Traditional Name: 3-amino-5-[[1-(4-amino-6,7-dimethoxy-quinazolin-2-yl)-4-piperidyl]amino]pyrazinic acid methyl ester Formula: C21H26N8O4 MolecularWeight: 454.48234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)NC4=CN=C(C(=N4)N)C(=O)OC)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCC(CC3)NC4=CN=C(C(=N4)N)C(=O)OC)N)OC

InChI

InChI=1S/C21H26N8O4/c1-31-14-8-12-13(9-15(14)32-2)26-21(28-18(12)22)29-6-4-11(5-7-29)25-16-10-24-17(19(23)27-16)20(30)33-3/h8-11H,4-7H2,1-3H3,(H2,22,26,28)(H3,23,25,27)