butyl 4-[[2,4-bis(azanyl)quinazolin-6-yl]methylamino]benzoate

Systemtic Name: butyl 4-[[2,4-bis(azanyl)quinazolin-6-yl]methylamino]benzoate Openeye Name: butyl 4-[(2,4-diaminoquinazolin-6-yl)methylamino]benzoate CAS Name: 4-[(2,4-diamino-6-quinazolinyl)methylamino]benzoic acid butyl ester IUPAC Name: butyl 4-[(2,4-diaminoquinazolin-6-yl)methylamino]benzoate Traditional Name: 4-[(2,4-diaminoquinazolin-6-yl)methylamino]benzoic acid butyl ester Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NCC2=CC3=C(C=C2)N=C(N=C3N)N

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NCC2=CC3=C(C=C2)N=C(N=C3N)N

InChI

InChI=1S/C20H23N5O2/c1-2-3-10-27-19(26)14-5-7-15(8-6-14)23-12-13-4-9-17-16(11-13)18(21)25-20(22)24-17/h4-9,11,23H,2-3,10,12H2,1H3,(H4,21,22,24,25)