N-(2-hydroxyethyl)-3-methyl-2-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]benzimidazole-5-carboxamide

Systemtic Name: N-(2-hydroxyethyl)-3-methyl-2-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]benzimidazole-5-carboxamide Openeye Name: N-(2-hydroxyethyl)-2-[4-(4-isopropylphenyl)-6-prop-2-ynoxy-quinazolin-2-yl]-3-methyl-benzimidazole-5-carboxamide CAS Name: N-(2-hydroxyethyl)-3-methyl-2-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxy-2-quinazolinyl]-5-benzimidazolecarboxamide IUPAC Name: N-(2-hydroxyethyl)-3-methyl-2-[4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazolin-2-yl]benzimidazole-5-carboxamide Traditional Name: N-(2-hydroxyethyl)-3-methyl-2-(4-p-cumenyl-6-propargyloxy-quinazolin-2-yl)benzimidazole-5-carboxamide Formula: C31H29N5O3 MolecularWeight: 519.59366

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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)C4=NC5=C(N4C)C=C(C=C5)C(=O)NCCO

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)OCC#C)C4=NC5=C(N4C)C=C(C=C5)C(=O)NCCO

InChI

InChI=1S/C31H29N5O3/c1-5-16-39-23-11-13-25-24(18-23)28(21-8-6-20(7-9-21)19(2)3)35-29(33-25)30-34-26-12-10-22(17-27(26)36(30)4)31(38)32-14-15-37/h1,6-13,17-19,37H,14-16H2,2-4H3,(H,32,38)