6-ethynyl-2-(imidazol-1-ylmethyl)-N-(2-methoxyethyl)quinazolin-4-amine

Systemtic Name: 6-ethynyl-2-(imidazol-1-ylmethyl)-N-(2-methoxyethyl)quinazolin-4-amine Openeye Name: 6-ethynyl-2-(imidazol-1-ylmethyl)-N-(2-methoxyethyl)quinazolin-4-amine CAS Name: 6-ethynyl-2-(1-imidazolylmethyl)-N-(2-methoxyethyl)-4-quinazolinamine IUPAC Name: 6-ethynyl-2-(imidazol-1-ylmethyl)-N-(2-methoxyethyl)quinazolin-4-amine Traditional Name: [6-ethynyl-2-(imidazol-1-ylmethyl)quinazolin-4-yl]-(2-methoxyethyl)amine Formula: C17H17N5O MolecularWeight: 307.34978

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NC(=NC2=C1C=C(C=C2)C#C)CN3C=CN=C3

Isomeric SMILES

COCCNC1=NC(=NC2=C1C=C(C=C2)C#C)CN3C=CN=C3

InChI

InChI=1S/C17H17N5O/c1-3-13-4-5-15-14(10-13)17(19-7-9-23-2)21-16(20-15)11-22-8-6-18-12-22/h1,4-6,8,10,12H,7,9,11H2,2H3,(H,19,20,21)