4-[(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)methylamino]-2-ethyl-3,5-dimethyl-benzamide

Systemtic Name: 4-[(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)methylamino]-2-ethyl-3,5-dimethyl-benzamide Openeye Name: 4-[(4-amino-6,7-dimethoxy-quinazolin-2-yl)methylamino]-2-ethyl-3,5-dimethyl-benzamide CAS Name: 4-[(4-amino-6,7-dimethoxy-2-quinazolinyl)methylamino]-2-ethyl-3,5-dimethylbenzamide IUPAC Name: 4-[(4-amino-6,7-dimethoxyquinazolin-2-yl)methylamino]-2-ethyl-3,5-dimethylbenzamide Traditional Name: 4-[(4-amino-6,7-dimethoxy-quinazolin-2-yl)methylamino]-2-ethyl-3,5-dimethyl-benzamide Formula: C22H27N5O3 MolecularWeight: 409.48148

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1C(=O)N)C)NCC2=NC3=CC(=C(C=C3C(=N2)N)OC)OC)C

Isomeric SMILES

CCC1=C(C(=C(C=C1C(=O)N)C)NCC2=NC3=CC(=C(C=C3C(=N2)N)OC)OC)C

InChI

InChI=1S/C22H27N5O3/c1-6-13-12(3)20(11(2)7-14(13)22(24)28)25-10-19-26-16-9-18(30-5)17(29-4)8-15(16)21(23)27-19/h7-9,25H,6,10H2,1-5H3,(H2,24,28)(H2,23,26,27)