N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(1,2,3-triazol-1-yl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(1,2,3-triazol-1-yl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide Openeye Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(triazol-1-yl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide CAS Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(1-triazolyl)ethoxy]-4-quinazolinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(triazol-1-yl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide Traditional Name: N-(4-cyanophenyl)-4-[6-methoxy-7-[2-(triazol-1-yl)ethoxy]quinazolin-4-yl]piperazine-1-carboxamide Formula: C25H25N9O3 MolecularWeight: 499.5245

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)OCCN5C=CN=N5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)OCCN5C=CN=N5

InChI

InChI=1S/C25H25N9O3/c1-36-22-14-20-21(15-23(22)37-13-12-34-7-6-29-31-34)27-17-28-24(20)32-8-10-33(11-9-32)25(35)30-19-4-2-18(16-26)3-5-19/h2-7,14-15,17H,8-13H2,1H3,(H,30,35)