N-(3,4-dicyanophenyl)-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazoline-2-carboxamide

Systemtic Name: N-(3,4-dicyanophenyl)-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazoline-2-carboxamide Openeye Name: N-(3,4-dicyanophenyl)-4-(4-isopropylphenyl)-6-prop-2-ynoxy-quinazoline-2-carboxamide CAS Name: N-(3,4-dicyanophenyl)-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-2-quinazolinecarboxamide IUPAC Name: N-(3,4-dicyanophenyl)-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazoline-2-carboxamide Traditional Name: N-(3,4-dicyanophenyl)-4-p-cumenyl-6-propargyloxy-quinazoline-2-carboxamide Formula: C29H21N5O2 MolecularWeight: 471.50934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)OCC#C)C(=O)NC4=CC(=C(C=C4)C#N)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)OCC#C)C(=O)NC4=CC(=C(C=C4)C#N)C#N

InChI

InChI=1S/C29H21N5O2/c1-4-13-36-24-11-12-26-25(15-24)27(20-7-5-19(6-8-20)18(2)3)34-28(33-26)29(35)32-23-10-9-21(16-30)22(14-23)17-31/h1,5-12,14-15,18H,13H2,2-3H3,(H,32,35)